[4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine

C16H26N2 — CID 107160658

IUPAC[4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine
SMILESCC1(CN)CCN(CCCc2ccccc2)CC1
InChIInChI=1S/C16H26N2/c1-16(14-17)9-12-18(13-10-16)11-5-8-15-6-3-2-4-7-15/h2-4,6-7H,5,8-14,17H2,1H3
InChIKeyHRNLWJMVDYMSGQ-UHFFFAOYSA-N
MW246.40 g/mol
LogP2.68
Rot. Bonds5

About [4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine

[4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine (PubChem CID 107160658) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is [4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine.

Molecular Properties

Compound Name[4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine
PubChem CID107160658
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Name[4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine
SMILESCC1(CN)CCN(CCCc2ccccc2)CC1
InChIInChI=1S/C16H26N2/c1-16(14-17)9-12-18(13-10-16)11-5-8-15-6-3-2-4-7-15/h2-4,6-7H,5,8-14,17H2,1H3
InChIKeyHRNLWJMVDYMSGQ-UHFFFAOYSA-N
XLogP2.68
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-methylsulfanyl-1-(4-phenylbutyl)piperidin-4-yl]methanamine
CID 114333073
ethane;2-[4-methyl-1-(2-phenylethyl)piperidin-4-yl]acetonitrile
CID 145395121
4-(4-chlorophenyl)-1-(3-phenylpropyl)piperidin-4-ol
CID 10892851
[3-methyl-1-[2-(4-methylphenyl)ethyl]pyrrolidin-3-yl]methanamine
CID 120773709
[1-(4-phenylbutyl)piperidin-4-yl]methanamine
CID 69419059
N-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine
CID 106318668
2-(1-methylcyclopropyl)ethylbenzene
CID 18548209
4-methyl-1-(4-phenylbutyl)piperidine
CID 118534913
2-[(3S)-3-methyl-3-(2-phenylethyl)pyrrolidin-1-yl]acetic acid
CID 125146477
3-amino-1-(4-phenylbutyl)pyrrolidine-3-carboxylic acid
CID 107325026
4-methyl-1-(2-phenylethyl)azepan-4-ol
CID 107408153
4-(phenoxymethyl)-1-(3-phenylpropyl)azepan-4-ol
CID 155990791

Frequently Asked Questions

What is the IUPAC name of [4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine?
The IUPAC name of [4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine (CID 107160658) is [4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine.
What is the SMILES notation for [4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine?
The canonical SMILES for [4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine is CC1(CN)CCN(CCCc2ccccc2)CC1.
What is the InChIKey of [4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine?
The InChIKey is HRNLWJMVDYMSGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-16(14-17)9-12-18(13-10-16)11-5-8-15-6-3-2-4-7-15/h2-4,6-7H,5,8-14,17H2,1H3.
What are the key properties of [4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine?
[4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine has a molecular weight of 246.40 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-(3-phenylpropyl)piperidin-4-yl]methanamine is sourced from PubChem (CID 107160658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).