1-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine

C15H24N2 — CID 28798848

IUPAC1-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine
SMILESCc1ccc(CN(C)C2(CN)CCCC2)cc1
InChIInChI=1S/C15H24N2/c1-13-5-7-14(8-6-13)11-17(2)15(12-16)9-3-4-10-15/h5-8H,3-4,9-12,16H2,1-2H3
InChIKeyLAVVPNZHLVSGKY-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.70
Rot. Bonds4

About 1-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine

1-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine (PubChem CID 28798848) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine
PubChem CID28798848
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine
SMILESCc1ccc(CN(C)C2(CN)CCCC2)cc1
InChIInChI=1S/C15H24N2/c1-13-5-7-14(8-6-13)11-17(2)15(12-16)9-3-4-10-15/h5-8H,3-4,9-12,16H2,1-2H3
InChIKeyLAVVPNZHLVSGKY-UHFFFAOYSA-N
XLogP2.70
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine?
The IUPAC name of 1-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine (CID 28798848) is 1-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine?
The canonical SMILES for 1-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine is Cc1ccc(CN(C)C2(CN)CCCC2)cc1.
What is the InChIKey of 1-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine?
The InChIKey is LAVVPNZHLVSGKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-13-5-7-14(8-6-13)11-17(2)15(12-16)9-3-4-10-15/h5-8H,3-4,9-12,16H2,1-2H3.
What are the key properties of 1-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine?
1-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 28798848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).