1-benzyl-N-(2,2-dimethylcyclopentyl)piperidin-3-amine

C19H30N2 — CID 79865795

IUPAC1-benzyl-N-(2,2-dimethylcyclopentyl)piperidin-3-amine
SMILESCC1(C)CCCC1NC1CCCN(Cc2ccccc2)C1
InChIInChI=1S/C19H30N2/c1-19(2)12-6-11-18(19)20-17-10-7-13-21(15-17)14-16-8-4-3-5-9-16/h3-5,8-9,17-18,20H,6-7,10-15H2,1-2H3
InChIKeyWAHZUVXYAJLTED-UHFFFAOYSA-N
MW286.46 g/mol
LogP3.82
Rot. Bonds4

About 1-benzyl-N-(2,2-dimethylcyclopentyl)piperidin-3-amine

1-benzyl-N-(2,2-dimethylcyclopentyl)piperidin-3-amine (PubChem CID 79865795) has the molecular formula C19H30N2 and a molecular weight of 286.46 g/mol. Its IUPAC name is 1-benzyl-N-(2,2-dimethylcyclopentyl)piperidin-3-amine.

Molecular Properties

Compound Name1-benzyl-N-(2,2-dimethylcyclopentyl)piperidin-3-amine
PubChem CID79865795
Molecular FormulaC19H30N2
Molecular Weight286.46 g/mol
Exact Mass286.24
IUPAC Name1-benzyl-N-(2,2-dimethylcyclopentyl)piperidin-3-amine
SMILESCC1(C)CCCC1NC1CCCN(Cc2ccccc2)C1
InChIInChI=1S/C19H30N2/c1-19(2)12-6-11-18(19)20-17-10-7-13-21(15-17)14-16-8-4-3-5-9-16/h3-5,8-9,17-18,20H,6-7,10-15H2,1-2H3
InChIKeyWAHZUVXYAJLTED-UHFFFAOYSA-N
XLogP3.82
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-1-benzyl-N-methylpiperidin-3-amine;sulfane
CID 162106706
[2-[(1-benzylpiperidin-4-yl)amino]-1-methylcyclopentyl]methanol
CID 111468841
1-benzyl-N-(3-methylcyclopentyl)piperidin-3-amine
CID 64592184
1-benzyl-N-(thian-4-yl)piperidin-3-amine
CID 60761750
1-[[(1-benzylpiperidin-3-yl)amino]methyl]cyclopentan-1-ol
CID 65105573
N-(1-benzylpyrrolidin-3-yl)-1-methylazepan-4-amine
CID 65070074
1-benzyl-N-(2-fluoroethyl)piperidin-3-amine
CID 80695683
1-benzyl-N-(oxolan-3-yl)piperidin-3-amine
CID 64590674
1-benzyl-N-butan-2-ylpiperidin-3-amine
CID 43145137
N-[(3S)-1-benzylpiperidin-3-yl]acetamide
CID 58526543
2-[[(3S)-1-benzylpiperidin-3-yl]amino]acetic acid
CID 66564975
3-[(1-benzylpiperidin-3-yl)amino]propane-1,2-diol
CID 66177195

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(2,2-dimethylcyclopentyl)piperidin-3-amine?
The IUPAC name of 1-benzyl-N-(2,2-dimethylcyclopentyl)piperidin-3-amine (CID 79865795) is 1-benzyl-N-(2,2-dimethylcyclopentyl)piperidin-3-amine.
What is the SMILES notation for 1-benzyl-N-(2,2-dimethylcyclopentyl)piperidin-3-amine?
The canonical SMILES for 1-benzyl-N-(2,2-dimethylcyclopentyl)piperidin-3-amine is CC1(C)CCCC1NC1CCCN(Cc2ccccc2)C1.
What is the InChIKey of 1-benzyl-N-(2,2-dimethylcyclopentyl)piperidin-3-amine?
The InChIKey is WAHZUVXYAJLTED-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2/c1-19(2)12-6-11-18(19)20-17-10-7-13-21(15-17)14-16-8-4-3-5-9-16/h3-5,8-9,17-18,20H,6-7,10-15H2,1-2H3.
What are the key properties of 1-benzyl-N-(2,2-dimethylcyclopentyl)piperidin-3-amine?
1-benzyl-N-(2,2-dimethylcyclopentyl)piperidin-3-amine has a molecular weight of 286.46 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(2,2-dimethylcyclopentyl)piperidin-3-amine is sourced from PubChem (CID 79865795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).