N-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine

C18H28N2 — CID 106899423

IUPACN-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine
SMILESCCc1ccc(CNC2CCCC2C2CCCN2)cc1
InChIInChI=1S/C18H28N2/c1-2-14-8-10-15(11-9-14)13-20-18-6-3-5-16(18)17-7-4-12-19-17/h8-11,16-20H,2-7,12-13H2,1H3
InChIKeyNVGYLRDAVCBZTG-UHFFFAOYSA-N
MW272.44 g/mol
LogP3.26
Rot. Bonds5

About N-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine

N-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine (PubChem CID 106899423) has the molecular formula C18H28N2 and a molecular weight of 272.44 g/mol. Its IUPAC name is N-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine
PubChem CID106899423
Molecular FormulaC18H28N2
Molecular Weight272.44 g/mol
Exact Mass272.23
IUPAC NameN-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine
SMILESCCc1ccc(CNC2CCCC2C2CCCN2)cc1
InChIInChI=1S/C18H28N2/c1-2-14-8-10-15(11-9-14)13-20-18-6-3-5-16(18)17-7-4-12-19-17/h8-11,16-20H,2-7,12-13H2,1H3
InChIKeyNVGYLRDAVCBZTG-UHFFFAOYSA-N
XLogP3.26
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.44
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine 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

N-[(4-propan-2-ylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine
CID 79537133
N-benzyl-2-piperidin-2-ylcyclopentan-1-amine
CID 79545054
N-[(5-ethylthiophen-2-yl)methyl]-2-piperidin-2-ylcyclopentan-1-amine
CID 106009248
N-[(1-methylpyrazol-4-yl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine
CID 79544285
N-[(3-methoxyphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine
CID 79544582
N-[(3-fluorophenyl)methyl]-2-piperidin-2-ylcyclopentan-1-amine
CID 79544989
N-[(2,5-difluorophenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine
CID 79543838
N-(1,2-oxazol-5-ylmethyl)-2-pyrrolidin-2-ylcyclopentan-1-amine
CID 106414949
N-(pyridin-3-ylmethyl)-2-pyrrolidin-2-ylcyclohexan-1-amine
CID 79545849
N-[(3-methoxyphenyl)methyl]-2-pyrrolidin-2-ylcyclohexan-1-amine
CID 79536668
N-(pyridin-2-ylmethyl)-2-pyrrolidin-2-ylcyclopentan-1-amine
CID 79543889
N-[(2-chlorophenyl)methyl]-2-piperidin-2-ylcyclopentan-1-amine
CID 79545200

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine?
The IUPAC name of N-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine (CID 106899423) is N-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine.
What is the SMILES notation for N-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine?
The canonical SMILES for N-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine is CCc1ccc(CNC2CCCC2C2CCCN2)cc1.
What is the InChIKey of N-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine?
The InChIKey is NVGYLRDAVCBZTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2/c1-2-14-8-10-15(11-9-14)13-20-18-6-3-5-16(18)17-7-4-12-19-17/h8-11,16-20H,2-7,12-13H2,1H3.
What are the key properties of N-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine?
N-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine has a molecular weight of 272.44 g/mol, XLogP of 3.26, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylphenyl)methyl]-2-pyrrolidin-2-ylcyclopentan-1-amine is sourced from PubChem (CID 106899423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).