N-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine

C15H32N2 — CID 62263552

IUPACN-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine
SMILESCC1CCCN(CC(C)(C)CNC(C)(C)C)C1
InChIInChI=1S/C15H32N2/c1-13-8-7-9-17(10-13)12-15(5,6)11-16-14(2,3)4/h13,16H,7-12H2,1-6H3
InChIKeySMKPKWPAYAFDCW-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.13
Rot. Bonds4

About N-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine

N-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine (PubChem CID 62263552) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is N-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine.

Molecular Properties

Compound NameN-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine
PubChem CID62263552
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC NameN-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine
SMILESCC1CCCN(CC(C)(C)CNC(C)(C)C)C1
InChIInChI=1S/C15H32N2/c1-13-8-7-9-17(10-13)12-15(5,6)11-16-14(2,3)4/h13,16H,7-12H2,1-6H3
InChIKeySMKPKWPAYAFDCW-UHFFFAOYSA-N
XLogP3.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-2,2-dimethyl-3-(4-methylazepan-1-yl)propan-1-amine
CID 55249989
N-tert-butyl-2-methyl-2-[(3-methylpiperidin-1-yl)methyl]butan-1-amine
CID 62262259
N-[2,2-dimethyl-3-(3-methylpiperidin-1-yl)propyl]cyclopropanamine
CID 62263551
2,2-dimethyl-3-(3-methylpiperidin-1-yl)-N-(2-methylpropyl)propan-1-amine
CID 62263553
2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine
CID 62262995
3-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-tert-butyl-2,2-dimethylpropan-1-amine
CID 79945391
3-methyl-1-(2,2,4-trimethylpentyl)piperidine
CID 118299028
N-tert-butyl-2,2-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propan-1-amine
CID 63168780
N,2,2-trimethyl-3-(3-methylpyrrolidin-1-yl)propan-1-amine
CID 62257427
3-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-N-tert-butyl-2,2-dimethylpropan-1-amine
CID 79924588
N-tert-butyl-3-[4-(cyclopropylmethyl)piperazin-1-yl]-2,2-dimethylpropan-1-amine
CID 62270799
2-[1-[3-(tert-butylamino)-2,2-dimethylpropyl]pyrrolidin-3-yl]ethanol
CID 114800051

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine?
The IUPAC name of N-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine (CID 62263552) is N-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine.
What is the SMILES notation for N-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine?
The canonical SMILES for N-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine is CC1CCCN(CC(C)(C)CNC(C)(C)C)C1.
What is the InChIKey of N-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine?
The InChIKey is SMKPKWPAYAFDCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-13-8-7-9-17(10-13)12-15(5,6)11-16-14(2,3)4/h13,16H,7-12H2,1-6H3.
What are the key properties of N-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine?
N-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine has a molecular weight of 240.43 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2,2-dimethyl-3-(3-methylpiperidin-1-yl)propan-1-amine is sourced from PubChem (CID 62263552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).