N-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine

C19H30N2 — CID 79537931

IUPACN-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine
SMILESCc1cccc(CCNC2CCCC2C2CCCCN2)c1
InChIInChI=1S/C19H30N2/c1-15-6-4-7-16(14-15)11-13-21-19-10-5-8-17(19)18-9-2-3-12-20-18/h4,6-7,14,17-21H,2-3,5,8-13H2,1H3
InChIKeyGUOJSESSJSZBKN-UHFFFAOYSA-N
MW286.46 g/mol
LogP3.44
Rot. Bonds5

About N-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine

N-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine (PubChem CID 79537931) has the molecular formula C19H30N2 and a molecular weight of 286.46 g/mol. Its IUPAC name is N-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine
PubChem CID79537931
Molecular FormulaC19H30N2
Molecular Weight286.46 g/mol
Exact Mass286.24
IUPAC NameN-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine
SMILESCc1cccc(CCNC2CCCC2C2CCCCN2)c1
InChIInChI=1S/C19H30N2/c1-15-6-4-7-16(14-15)11-13-21-19-10-5-8-17(19)18-9-2-3-12-20-18/h4,6-7,14,17-21H,2-3,5,8-13H2,1H3
InChIKeyGUOJSESSJSZBKN-UHFFFAOYSA-N
XLogP3.44
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[2-(3-methylphenyl)ethyl]cyclohexan-1-amine
CID 55062515
4-[2-[(2-piperidin-2-ylcyclopentyl)amino]ethyl]phenol
CID 79536288
N-benzyl-2-piperidin-2-ylcyclopentan-1-amine
CID 79545054
2-piperidin-2-yl-N-(2-thiophen-3-ylethyl)cyclopentan-1-amine
CID 79545243
N-[(3-fluorophenyl)methyl]-2-piperidin-2-ylcyclopentan-1-amine
CID 79544989
N-[2-(3-methylphenyl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 63477283
N-[(1S)-1-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine
CID 81367096
N-[2-(2-methylpyrazol-3-yl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine
CID 103004984
N-[(3-methoxyphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine
CID 79544582
N-[2-(1-methylpyrazol-3-yl)ethyl]-2-piperidin-2-ylcyclohexan-1-amine
CID 106104216
N-[(3-methoxyphenyl)methyl]-2-pyrrolidin-2-ylcyclohexan-1-amine
CID 79536668
N-[(1S)-1-(3-methylphenyl)ethyl]-2-pyrrolidin-2-ylcyclohexan-1-amine
CID 81369615

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine?
The IUPAC name of N-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine (CID 79537931) is N-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine.
What is the SMILES notation for N-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine?
The canonical SMILES for N-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine is Cc1cccc(CCNC2CCCC2C2CCCCN2)c1.
What is the InChIKey of N-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine?
The InChIKey is GUOJSESSJSZBKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2/c1-15-6-4-7-16(14-15)11-13-21-19-10-5-8-17(19)18-9-2-3-12-20-18/h4,6-7,14,17-21H,2-3,5,8-13H2,1H3.
What are the key properties of N-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine?
N-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine has a molecular weight of 286.46 g/mol, XLogP of 3.44, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine is sourced from PubChem (CID 79537931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).