1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine

C14H22N2 — CID 65384422

IUPAC1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine
SMILESCC1CCCC1(CN)NCc1ccccc1
InChIInChI=1S/C14H22N2/c1-12-6-5-9-14(12,11-15)16-10-13-7-3-2-4-8-13/h2-4,7-8,12,16H,5-6,9-11,15H2,1H3
InChIKeyASAGOSPTDALPJO-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.29
Rot. Bonds4

About 1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine

1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine (PubChem CID 65384422) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine
PubChem CID65384422
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine
SMILESCC1CCCC1(CN)NCc1ccccc1
InChIInChI=1S/C14H22N2/c1-12-6-5-9-14(12,11-15)16-10-13-7-3-2-4-8-13/h2-4,7-8,12,16H,5-6,9-11,15H2,1H3
InChIKeyASAGOSPTDALPJO-UHFFFAOYSA-N
XLogP2.29
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine?
The IUPAC name of 1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine (CID 65384422) is 1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine?
The canonical SMILES for 1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine is CC1CCCC1(CN)NCc1ccccc1.
What is the InChIKey of 1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine?
The InChIKey is ASAGOSPTDALPJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-12-6-5-9-14(12,11-15)16-10-13-7-3-2-4-8-13/h2-4,7-8,12,16H,5-6,9-11,15H2,1H3.
What are the key properties of 1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine?
1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine has a molecular weight of 218.34 g/mol, XLogP of 2.29, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-benzyl-2-methylcyclopentan-1-amine is sourced from PubChem (CID 65384422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).