1-[4-(cyclopenten-1-yl)phenyl]-N-methyl-1-phenylmethanamine

C19H21N — CID 155571905

IUPAC1-[4-(cyclopenten-1-yl)phenyl]-N-methyl-1-phenylmethanamine
SMILESCNC(c1ccccc1)c1ccc(C2=CCCC2)cc1
InChIInChI=1S/C19H21N/c1-20-19(17-9-3-2-4-10-17)18-13-11-16(12-14-18)15-7-5-6-8-15/h2-4,7,9-14,19-20H,5-6,8H2,1H3
InChIKeyXPOKITGWEKVVBH-UHFFFAOYSA-N
MW263.38 g/mol
LogP4.56
Rot. Bonds4

About 1-[4-(cyclopenten-1-yl)phenyl]-N-methyl-1-phenylmethanamine

1-[4-(cyclopenten-1-yl)phenyl]-N-methyl-1-phenylmethanamine (PubChem CID 155571905) has the molecular formula C19H21N and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-[4-(cyclopenten-1-yl)phenyl]-N-methyl-1-phenylmethanamine.

Molecular Properties

Compound Name1-[4-(cyclopenten-1-yl)phenyl]-N-methyl-1-phenylmethanamine
PubChem CID155571905
Molecular FormulaC19H21N
Molecular Weight263.38 g/mol
Exact Mass263.17
IUPAC Name1-[4-(cyclopenten-1-yl)phenyl]-N-methyl-1-phenylmethanamine
SMILESCNC(c1ccccc1)c1ccc(C2=CCCC2)cc1
InChIInChI=1S/C19H21N/c1-20-19(17-9-3-2-4-10-17)18-13-11-16(12-14-18)15-7-5-6-8-15/h2-4,7,9-14,19-20H,5-6,8H2,1H3
InChIKeyXPOKITGWEKVVBH-UHFFFAOYSA-N
XLogP4.56
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(cyclopenten-1-yl)phenyl]-N-methyl-1-phenylmethanamine?
The IUPAC name of 1-[4-(cyclopenten-1-yl)phenyl]-N-methyl-1-phenylmethanamine (CID 155571905) is 1-[4-(cyclopenten-1-yl)phenyl]-N-methyl-1-phenylmethanamine.
What is the SMILES notation for 1-[4-(cyclopenten-1-yl)phenyl]-N-methyl-1-phenylmethanamine?
The canonical SMILES for 1-[4-(cyclopenten-1-yl)phenyl]-N-methyl-1-phenylmethanamine is CNC(c1ccccc1)c1ccc(C2=CCCC2)cc1.
What is the InChIKey of 1-[4-(cyclopenten-1-yl)phenyl]-N-methyl-1-phenylmethanamine?
The InChIKey is XPOKITGWEKVVBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N/c1-20-19(17-9-3-2-4-10-17)18-13-11-16(12-14-18)15-7-5-6-8-15/h2-4,7,9-14,19-20H,5-6,8H2,1H3.
What are the key properties of 1-[4-(cyclopenten-1-yl)phenyl]-N-methyl-1-phenylmethanamine?
1-[4-(cyclopenten-1-yl)phenyl]-N-methyl-1-phenylmethanamine has a molecular weight of 263.38 g/mol, XLogP of 4.56, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(cyclopenten-1-yl)phenyl]-N-methyl-1-phenylmethanamine is sourced from PubChem (CID 155571905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).