(3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine

C67H148N14O5 — CID 158198814

IUPAC(3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine
SMILESCC(C)(C)N1CC[C@@H](O)[C@@H](N)C1.CC(C)(C)N1CC[C@H](O)[C@@H](N)C1.CC(C)(C)N1CC[C@H](O)[C@H](N)C1.C[C@@H]1CN(C(C)(C)C)C[C@H](N)[C@H]1O.C[C@@H]1C[C@H](N)CN(C(C)(C)C)C1.C[C@H]1CN(C(C)(C)C)C[C@@H](N)[C@@H]1O.C[C@H]1C[C@@H](N)CN(C(C)(C)C)C1
InChIInChI=1S/2C10H22N2O.2C10H22N2.3C9H20N2O/c2*1-7-5-12(10(2,3)4)6-8(11)9(7)13;2*1-8-5-9(11)7-12(6-8)10(2,3)4;3*1-9(2,3)11-5-4-8(12)7(10)6-11/h2*7-9,13H,5-6,11H2,1-4H3;2*8-9H,5-7,11H2,1-4H3;3*7-8,12H,4-6,10H2,1-3H3/t2*7-,8+,9+;2*8-,9+;2*7-,8+;7-,8-/m1010100/s1
InChIKeyGARGGHKGXOZJLF-QJPGXKRFSA-N
MW1230.01 g/mol
LogP4.29
Rot. Bonds

About (3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine

(3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine (PubChem CID 158198814) has the molecular formula C67H148N14O5 and a molecular weight of 1230.01 g/mol. Its IUPAC name is (3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine.

Molecular Properties

Compound Name(3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine
PubChem CID158198814
Molecular FormulaC67H148N14O5
Molecular Weight1230.01 g/mol
Exact Mass1229.18
IUPAC Name(3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine
SMILESCC(C)(C)N1CC[C@@H](O)[C@@H](N)C1.CC(C)(C)N1CC[C@H](O)[C@@H](N)C1.CC(C)(C)N1CC[C@H](O)[C@H](N)C1.C[C@@H]1CN(C(C)(C)C)C[C@H](N)[C@H]1O.C[C@@H]1C[C@H](N)CN(C(C)(C)C)C1.C[C@H]1CN(C(C)(C)C)C[C@@H](N)[C@@H]1O.C[C@H]1C[C@@H](N)CN(C(C)(C)C)C1
InChIInChI=1S/2C10H22N2O.2C10H22N2.3C9H20N2O/c2*1-7-5-12(10(2,3)4)6-8(11)9(7)13;2*1-8-5-9(11)7-12(6-8)10(2,3)4;3*1-9(2,3)11-5-4-8(12)7(10)6-11/h2*7-9,13H,5-6,11H2,1-4H3;2*8-9H,5-7,11H2,1-4H3;3*7-8,12H,4-6,10H2,1-3H3/t2*7-,8+,9+;2*8-,9+;2*7-,8+;7-,8-/m1010100/s1
InChIKeyGARGGHKGXOZJLF-QJPGXKRFSA-N
XLogP4.29
TPSA305.97 Ų
H-Bond Donors12
H-Bond Acceptors19
Rotatable Bonds
Heavy Atoms86
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001230.01
LogP ≤ 54.29
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1019

Analyze (3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine with MolForge

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Launch Full Analysis

Related Compounds

3-Amino-1-tert-butyl-5-methylpiperidin-4-ol;3-amino-1-tert-butyl-5-(trifluoromethyl)piperidin-4-ol;1-tert-butyl-5-cyclopropylpiperidin-3-amine;1-tert-butyl-5-methylpiperidin-3-amine;1-tert-butylpiperidin-3-amine;1-tert-butyl-5-(trifluoromethyl)piperidin-3-amine
CID 159336900
3-Amino-1-tert-butyl-5-methylpiperidin-4-ol;1-tert-butyl-5-methylpiperidin-3-amine;1-tert-butylpiperidin-3-amine;1-tert-butyl-5-(trifluoromethyl)piperidin-3-amine
CID 161622913
(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1,5-dimethylpiperidin-4-ol;bis((3S,5R)-1,5-dimethylpiperidin-3-amine);ethane;bis((3S)-1-methylpiperidin-3-amine)
CID 157140155
(3R,4R,5S)-3-amino-1-tert-butyl-5-cyclopropylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-4,5-dimethylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R)-1-tert-butyl-4-fluoropiperidin-3-amine;bis((3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine);(3S)-1-tert-butylpiperidin-3-amine
CID 157588701
3-Amino-1-tert-butyl-5-cyclopropylpiperidin-4-ol;3-amino-1-tert-butyl-4,5-dimethylpiperidin-4-ol;3-amino-1-tert-butyl-5-methylpiperidin-4-ol;1-tert-butyl-4-fluoropiperidin-3-amine;bis(1-tert-butyl-5-methylpiperidin-3-amine);1-tert-butylpiperidin-3-amine
CID 157588702
1-tert-butyl-N,N-dimethylpiperidin-4-amine;1-tert-butyl-4-methylpiperazine;4-tert-butylmorpholine;1-tert-butylpiperidin-4-ol;4-(1-tert-butylpiperidin-4-yl)-2,6-dimethylmorpholine;1-(1-tert-butylpiperidin-4-yl)-4-methylpiperazine;4-(1-tert-butylpiperidin-4-yl)morpholine;1-(1-tert-butylpiperidin-4-yl)piperazine;1-(1-tert-butylpiperidin-4-yl)-4-propan-2-ylpiperazine;1-tert-butyl-4-propan-2-ylpiperazine
CID 158097837
(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S)-1-tert-butylpiperidin-3-amine;(3R)-1-tert-butylpiperidin-3-amine;methyl N-(3-amino-1-tert-butyl-5-methylpiperidin-4-yl)carbamate
CID 158204782
(3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;bis((3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine);bis((3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine)
CID 158274179
(3R,4R,5S)-3-amino-1-tert-butyl-5-cyclopropylpiperidin-4-ol;bis((3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol);(3S,5S)-1-tert-butyl-5-cyclopropylpiperidin-3-amine;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine
CID 158581312
(3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;bis((3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine);bis((3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine)
CID 158769273
(3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;bis((3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine);(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine
CID 158835019
2-[Methyl(propan-2-yl)amino]ethanol;1-methyl-4-propan-2-ylpiperazine;4-methyl-1-propan-2-ylpiperidin-4-ol;1-methyl-4-(1-propan-2-ylpiperidin-4-yl)piperazine;2-(4-propan-2-ylpiperazin-1-yl)ethanol;1-propan-2-ylpiperidin-4-ol
CID 159032777

Frequently Asked Questions

What is the IUPAC name of (3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine?
The IUPAC name of (3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine (CID 158198814) is (3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine.
What is the SMILES notation for (3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine?
The canonical SMILES for (3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine is CC(C)(C)N1CC[C@@H](O)[C@@H](N)C1.CC(C)(C)N1CC[C@H](O)[C@@H](N)C1.CC(C)(C)N1CC[C@H](O)[C@H](N)C1.C[C@@H]1CN(C(C)(C)C)C[C@H](N)[C@H]1O.C[C@@H]1C[C@H](N)CN(C(C)(C)C)C1.C[C@H]1CN(C(C)(C)C)C[C@@H](N)[C@@H]1O.C[C@H]1C[C@@H](N)CN(C(C)(C)C)C1.
What is the InChIKey of (3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine?
The InChIKey is GARGGHKGXOZJLF-QJPGXKRFSA-N. The full InChI is InChI=1S/2C10H22N2O.2C10H22N2.3C9H20N2O/c2*1-7-5-12(10(2,3)4)6-8(11)9(7)13;2*1-8-5-9(11)7-12(6-8)10(2,3)4;3*1-9(2,3)11-5-4-8(12)7(10)6-11/h2*7-9,13H,5-6,11H2,1-4H3;2*8-9H,5-7,11H2,1-4H3;3*7-8,12H,4-6,10H2,1-3H3/t2*7-,8+,9+;2*8-,9+;2*7-,8+;7-,8-/m1010100/s1.
What are the key properties of (3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine?
(3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine has a molecular weight of 1230.01 g/mol, XLogP of 4.29, 0 rotatable bonds, 12 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,4S,5R)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3R,4R,5S)-3-amino-1-tert-butyl-5-methylpiperidin-4-ol;(3S,4R)-3-amino-1-tert-butylpiperidin-4-ol;(3S,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3R,4S)-3-amino-1-tert-butylpiperidin-4-ol;(3S,5R)-1-tert-butyl-5-methylpiperidin-3-amine;(3R,5S)-1-tert-butyl-5-methylpiperidin-3-amine is sourced from PubChem (CID 158198814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).