2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine

C15H24N2O — CID 61419887

IUPAC2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine
SMILESCOc1cccc(CN(C)C2CCCC2CN)c1
InChIInChI=1S/C15H24N2O/c1-17(15-8-4-6-13(15)10-16)11-12-5-3-7-14(9-12)18-2/h3,5,7,9,13,15H,4,6,8,10-11,16H2,1-2H3
InChIKeyRVIGVHHNHWRBSN-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.25
Rot. Bonds5

About 2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine

2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine (PubChem CID 61419887) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine
PubChem CID61419887
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine
SMILESCOc1cccc(CN(C)C2CCCC2CN)c1
InChIInChI=1S/C15H24N2O/c1-17(15-8-4-6-13(15)10-16)11-12-5-3-7-14(9-12)18-2/h3,5,7,9,13,15H,4,6,8,10-11,16H2,1-2H3
InChIKeyRVIGVHHNHWRBSN-UHFFFAOYSA-N
XLogP2.25
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-[(3-methoxyphenyl)methyl]-2-N-methylcyclohexane-1,2-diamine
CID 61420564
2-(aminomethyl)-N-methyl-N-[(3-methylphenyl)methyl]cyclopentan-1-amine
CID 61414255
N-[(3-methoxyphenyl)methyl]-N-methyl-2-methylsulfonylcyclopentan-1-amine
CID 75386810
1-N-[(3-methoxyphenyl)methyl]-1-N-methylcyclohexane-1,3-diamine
CID 79468311
[2-[(3-methoxyphenyl)methoxy]cyclopentyl]methanamine
CID 43428902
N-[(3-methoxyphenyl)methyl]-N-methyltricyclo[5.2.1.02,6]decan-8-amine
CID 72609978
[2-[(3-methoxyphenyl)methyl]cyclobutyl]methanamine
CID 81011141
2-(aminomethyl)-N-methyl-N-[(4-phenylmethoxyphenyl)methyl]cyclohexan-1-amine
CID 113242171
2-N-[(3-methoxyphenyl)methyl]-2-N-methyl-4-propan-2-ylcyclohexane-1,2-diamine
CID 62708961
[2-[(3-methoxyphenyl)methoxy]cyclohexyl]methanamine
CID 43329442
(3aR,7aS)-4-[(3-methoxyphenyl)methyl-methylamino]-1,3,3a,4,5,6,7,7a-octahydroisoindole-2-carboxamide;2,2,2-trifluoroacetic acid
CID 155839772
1-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine
CID 61420272

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine?
The IUPAC name of 2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine (CID 61419887) is 2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine.
What is the SMILES notation for 2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine?
The canonical SMILES for 2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine is COc1cccc(CN(C)C2CCCC2CN)c1.
What is the InChIKey of 2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine?
The InChIKey is RVIGVHHNHWRBSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-17(15-8-4-6-13(15)10-16)11-12-5-3-7-14(9-12)18-2/h3,5,7,9,13,15H,4,6,8,10-11,16H2,1-2H3.
What are the key properties of 2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine?
2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine has a molecular weight of 248.37 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-[(3-methoxyphenyl)methyl]-N-methylcyclopentan-1-amine is sourced from PubChem (CID 61419887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).