N-[(3-cyclopropylphenyl)methyl]cyclopentanamine

C15H21N — CID 79979605

IUPACN-[(3-cyclopropylphenyl)methyl]cyclopentanamine
SMILESc1cc(CNC2CCCC2)cc(C2CC2)c1
InChIInChI=1S/C15H21N/c1-2-7-15(6-1)16-11-12-4-3-5-14(10-12)13-8-9-13/h3-5,10,13,15-16H,1-2,6-9,11H2
InChIKeyKMEMIMURDNNDQT-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.60
Rot. Bonds4

About N-[(3-cyclopropylphenyl)methyl]cyclopentanamine

N-[(3-cyclopropylphenyl)methyl]cyclopentanamine (PubChem CID 79979605) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is N-[(3-cyclopropylphenyl)methyl]cyclopentanamine.

Molecular Properties

Compound NameN-[(3-cyclopropylphenyl)methyl]cyclopentanamine
PubChem CID79979605
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC NameN-[(3-cyclopropylphenyl)methyl]cyclopentanamine
SMILESc1cc(CNC2CCCC2)cc(C2CC2)c1
InChIInChI=1S/C15H21N/c1-2-7-15(6-1)16-11-12-4-3-5-14(10-12)13-8-9-13/h3-5,10,13,15-16H,1-2,6-9,11H2
InChIKeyKMEMIMURDNNDQT-UHFFFAOYSA-N
XLogP3.60
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(3-cyclopropylphenyl)methyl]cyclopentanamine?
The IUPAC name of N-[(3-cyclopropylphenyl)methyl]cyclopentanamine (CID 79979605) is N-[(3-cyclopropylphenyl)methyl]cyclopentanamine.
What is the SMILES notation for N-[(3-cyclopropylphenyl)methyl]cyclopentanamine?
The canonical SMILES for N-[(3-cyclopropylphenyl)methyl]cyclopentanamine is c1cc(CNC2CCCC2)cc(C2CC2)c1.
What is the InChIKey of N-[(3-cyclopropylphenyl)methyl]cyclopentanamine?
The InChIKey is KMEMIMURDNNDQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-2-7-15(6-1)16-11-12-4-3-5-14(10-12)13-8-9-13/h3-5,10,13,15-16H,1-2,6-9,11H2.
What are the key properties of N-[(3-cyclopropylphenyl)methyl]cyclopentanamine?
N-[(3-cyclopropylphenyl)methyl]cyclopentanamine has a molecular weight of 215.34 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-cyclopropylphenyl)methyl]cyclopentanamine is sourced from PubChem (CID 79979605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).