1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine

C19H30N2 — CID 63821124

IUPAC1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine
SMILESCC1(CNC2CCN(Cc3ccccc3)CC2)CCCC1
InChIInChI=1S/C19H30N2/c1-19(11-5-6-12-19)16-20-18-9-13-21(14-10-18)15-17-7-3-2-4-8-17/h2-4,7-8,18,20H,5-6,9-16H2,1H3
InChIKeyXCUVDSJOCIHWKX-UHFFFAOYSA-N
MW286.46 g/mol
LogP3.82
Rot. Bonds5

About 1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine

1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine (PubChem CID 63821124) has the molecular formula C19H30N2 and a molecular weight of 286.46 g/mol. Its IUPAC name is 1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine.

Molecular Properties

Compound Name1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine
PubChem CID63821124
Molecular FormulaC19H30N2
Molecular Weight286.46 g/mol
Exact Mass286.24
IUPAC Name1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine
SMILESCC1(CNC2CCN(Cc3ccccc3)CC2)CCCC1
InChIInChI=1S/C19H30N2/c1-19(11-5-6-12-19)16-20-18-9-13-21(14-10-18)15-17-7-3-2-4-8-17/h2-4,7-8,18,20H,5-6,9-16H2,1H3
InChIKeyXCUVDSJOCIHWKX-UHFFFAOYSA-N
XLogP3.82
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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

1-benzyl-N-[(1-methylcyclopropyl)methyl]piperidin-4-amine
CID 103724488
1-benzyl-N-[(1-ethylcyclobutyl)methyl]piperidin-4-amine
CID 103741195
1-benzyl-N-[(1-ethylcyclopropyl)methyl]piperidin-4-amine
CID 103735414
1-benzyl-N-[[1-(methoxymethyl)cyclopentyl]methyl]piperidin-4-amine
CID 122566362
1-benzyl-N-[(4-methyloxan-4-yl)methyl]pyrrolidin-3-amine
CID 103748644
(3S)-3-[[(1-benzylpiperidin-4-yl)amino]methyl]-1-methylpyrrolidin-3-ol
CID 99777650
1-benzyl-N-methylpiperidin-4-amine
CID 4136128
1-benzyl-N-[(1-ethylcyclobutyl)methyl]pyrrolidin-3-amine
CID 103748632
1-benzyl-N-(1-methylcyclopropyl)pyrrolidin-3-amine
CID 162433803
[2-[(1-benzylpiperidin-4-yl)amino]-1-methylcyclopentyl]methanol
CID 111468841
N-[(1-methylcyclopentyl)methyl]-1-propylpiperidin-4-amine
CID 63822212
1-benzyl-N-butylpiperidin-4-amine
CID 11253643

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine?
The IUPAC name of 1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine (CID 63821124) is 1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine.
What is the SMILES notation for 1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine?
The canonical SMILES for 1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine is CC1(CNC2CCN(Cc3ccccc3)CC2)CCCC1.
What is the InChIKey of 1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine?
The InChIKey is XCUVDSJOCIHWKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2/c1-19(11-5-6-12-19)16-20-18-9-13-21(14-10-18)15-17-7-3-2-4-8-17/h2-4,7-8,18,20H,5-6,9-16H2,1H3.
What are the key properties of 1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine?
1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine has a molecular weight of 286.46 g/mol, XLogP of 3.82, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-[(1-methylcyclopentyl)methyl]piperidin-4-amine is sourced from PubChem (CID 63821124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).