N-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-amine

C19H30N2 — CID 61212536

IUPACN-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-amine
SMILESCN1CCCC(NC(c2ccccc2)C2CCCCC2)C1
InChIInChI=1S/C19H30N2/c1-21-14-8-13-18(15-21)20-19(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2,4-5,9-10,17-20H,3,6-8,11-15H2,1H3
InChIKeyYVMHRUXTVJFVSX-UHFFFAOYSA-N
MW286.46 g/mol
LogP3.99
Rot. Bonds4

About N-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-amine

N-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-amine (PubChem CID 61212536) has the molecular formula C19H30N2 and a molecular weight of 286.46 g/mol. Its IUPAC name is N-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-amine.

Molecular Properties

Compound NameN-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-amine
PubChem CID61212536
Molecular FormulaC19H30N2
Molecular Weight286.46 g/mol
Exact Mass286.24
IUPAC NameN-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-amine
SMILESCN1CCCC(NC(c2ccccc2)C2CCCCC2)C1
InChIInChI=1S/C19H30N2/c1-21-14-8-13-18(15-21)20-19(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2,4-5,9-10,17-20H,3,6-8,11-15H2,1H3
InChIKeyYVMHRUXTVJFVSX-UHFFFAOYSA-N
XLogP3.99
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 ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[cyclopropyl(phenyl)methyl]-1-(1-methylpiperidin-3-yl)ethanamine
CID 43724248
1-methyl-N-[phenyl(pyridin-4-yl)methyl]piperidin-3-amine
CID 61210102
N-[cyclohexyl(phenyl)methyl]-4-methylpiperazin-1-amine
CID 83009042
(3S)-1-methyl-N-(1-phenylethyl)pyrrolidin-3-amine
CID 134939795
1-methyl-N-[(1S)-1-phenylethyl]azepan-4-amine
CID 81350289
1-methyl-N-(4-phenylbutan-2-yl)piperidin-3-amine
CID 61210453
N-[cyclopentyl(thiophen-2-yl)methyl]-1-methylpyrrolidin-3-amine
CID 61462402
N-[1-(3-bromophenyl)ethyl]-1-methylpiperidin-3-amine
CID 61210641
(3S)-1-methyl-N-[(1R)-1-phenyl-2-pyrrolidin-1-ylethyl]pyrrolidin-3-amine
CID 102595788
N-[cyclohexyl(phenyl)methyl]-2-[4-(1-methylpiperidin-3-yl)piperazin-1-yl]acetamide
CID 86959379
N-[cyclohexyl(phenyl)methyl]-2,5-dimethylpyrrol-1-amine
CID 79107738
N-(1-phenylethyl)cyclododecanamine
CID 60662638

Frequently Asked Questions

What is the IUPAC name of N-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-amine?
The IUPAC name of N-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-amine (CID 61212536) is N-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-amine.
What is the SMILES notation for N-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-amine?
The canonical SMILES for N-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-amine is CN1CCCC(NC(c2ccccc2)C2CCCCC2)C1.
What is the InChIKey of N-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-amine?
The InChIKey is YVMHRUXTVJFVSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2/c1-21-14-8-13-18(15-21)20-19(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2,4-5,9-10,17-20H,3,6-8,11-15H2,1H3.
What are the key properties of N-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-amine?
N-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-amine has a molecular weight of 286.46 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclohexyl(phenyl)methyl]-1-methylpiperidin-3-amine is sourced from PubChem (CID 61212536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).