3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine

C19H23N — CID 114543884

IUPAC3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine
SMILESCC1CCC(NCc2ccc(-c3ccccc3)cc2)C1
InChIInChI=1S/C19H23N/c1-15-7-12-19(13-15)20-14-16-8-10-18(11-9-16)17-5-3-2-4-6-17/h2-6,8-11,15,19-20H,7,12-14H2,1H3
InChIKeyTVEMDJMKYXTBRX-UHFFFAOYSA-N
MW265.40 g/mol
LogP4.63
Rot. Bonds4

About 3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine

3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine (PubChem CID 114543884) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is 3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine
PubChem CID114543884
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC Name3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine
SMILESCC1CCC(NCc2ccc(-c3ccccc3)cc2)C1
InChIInChI=1S/C19H23N/c1-15-7-12-19(13-15)20-14-16-8-10-18(11-9-16)17-5-3-2-4-6-17/h2-6,8-11,15,19-20H,7,12-14H2,1H3
InChIKeyTVEMDJMKYXTBRX-UHFFFAOYSA-N
XLogP4.63
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine?
The IUPAC name of 3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine (CID 114543884) is 3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine?
The canonical SMILES for 3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine is CC1CCC(NCc2ccc(-c3ccccc3)cc2)C1.
What is the InChIKey of 3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine?
The InChIKey is TVEMDJMKYXTBRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N/c1-15-7-12-19(13-15)20-14-16-8-10-18(11-9-16)17-5-3-2-4-6-17/h2-6,8-11,15,19-20H,7,12-14H2,1H3.
What are the key properties of 3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine?
3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine has a molecular weight of 265.40 g/mol, XLogP of 4.63, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 114543884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).