(3R,5S)-N-tert-butyl-5-methoxypiperidin-3-amine

C10H22N2O — CID 165388179

IUPAC(3R,5S)-N-tert-butyl-5-methoxypiperidin-3-amine
SMILESCO[C@@H]1CNC[C@H](NC(C)(C)C)C1
InChIInChI=1S/C10H22N2O/c1-10(2,3)12-8-5-9(13-4)7-11-6-8/h8-9,11-12H,5-7H2,1-4H3/t8-,9+/m1/s1
InChIKeyYWKUJVYXAVODMO-BDAKNGLRSA-N
MW186.30 g/mol
LogP0.75
Rot. Bonds2

About (3R,5S)-N-tert-butyl-5-methoxypiperidin-3-amine

(3R,5S)-N-tert-butyl-5-methoxypiperidin-3-amine (PubChem CID 165388179) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is (3R,5S)-N-tert-butyl-5-methoxypiperidin-3-amine.

Molecular Properties

Compound Name(3R,5S)-N-tert-butyl-5-methoxypiperidin-3-amine
PubChem CID165388179
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name(3R,5S)-N-tert-butyl-5-methoxypiperidin-3-amine
SMILESCO[C@@H]1CNC[C@H](NC(C)(C)C)C1
InChIInChI=1S/C10H22N2O/c1-10(2,3)12-8-5-9(13-4)7-11-6-8/h8-9,11-12H,5-7H2,1-4H3/t8-,9+/m1/s1
InChIKeyYWKUJVYXAVODMO-BDAKNGLRSA-N
XLogP0.75
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-Methoxypiperidin-3-amine dihydrochloride
CID 137951869
4-Methoxypiperidin-3-amine
CID 76223539
N-[3-[(2R)-4-(2-fluoroethyl)morpholin-2-yl]propyl]-2-methylpropan-2-amine
CID 166926466
2-(3-methoxypiperidin-1-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 113758784
1-Ethyl-3-methoxypiperidin-4-amine
CID 13677841
(3S,4R)-3-methoxy-N,N-dimethylpiperidin-4-amine
CID 15078440
1-(6-ethyl-4-methyl-1,3-oxazinan-2-yl)-N-methylmethanamine
CID 19874170
3-methoxy-N,N-dimethylpiperidin-4-amine
CID 19994869
1-ethyl-5-methoxy-N-methylpiperidin-3-amine
CID 20705141
5-methoxy-N,1-dimethylpiperidin-3-amine
CID 20705158
5-methoxy-1-N,3-N-dimethylpiperidine-1,3-diamine
CID 20705160
1-N-ethyl-5-methoxy-3-N-methylpiperidine-1,3-diamine
CID 20705170

Frequently Asked Questions

What is the IUPAC name of (3R,5S)-N-tert-butyl-5-methoxypiperidin-3-amine?
The IUPAC name of (3R,5S)-N-tert-butyl-5-methoxypiperidin-3-amine (CID 165388179) is (3R,5S)-N-tert-butyl-5-methoxypiperidin-3-amine.
What is the SMILES notation for (3R,5S)-N-tert-butyl-5-methoxypiperidin-3-amine?
The canonical SMILES for (3R,5S)-N-tert-butyl-5-methoxypiperidin-3-amine is CO[C@@H]1CNC[C@H](NC(C)(C)C)C1.
What is the InChIKey of (3R,5S)-N-tert-butyl-5-methoxypiperidin-3-amine?
The InChIKey is YWKUJVYXAVODMO-BDAKNGLRSA-N. The full InChI is InChI=1S/C10H22N2O/c1-10(2,3)12-8-5-9(13-4)7-11-6-8/h8-9,11-12H,5-7H2,1-4H3/t8-,9+/m1/s1.
What are the key properties of (3R,5S)-N-tert-butyl-5-methoxypiperidin-3-amine?
(3R,5S)-N-tert-butyl-5-methoxypiperidin-3-amine has a molecular weight of 186.30 g/mol, XLogP of 0.75, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,5S)-N-tert-butyl-5-methoxypiperidin-3-amine is sourced from PubChem (CID 165388179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).