N-[(3-propan-2-ylphenyl)methyl]cyclopentanamine

C15H23N — CID 126684599

IUPACN-[(3-propan-2-ylphenyl)methyl]cyclopentanamine
SMILESCC(C)c1cccc(CNC2CCCC2)c1
InChIInChI=1S/C15H23N/c1-12(2)14-7-5-6-13(10-14)11-16-15-8-3-4-9-15/h5-7,10,12,15-16H,3-4,8-9,11H2,1-2H3
InChIKeyGLNAIKXMOWUQEB-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.84
Rot. Bonds4

About N-[(3-propan-2-ylphenyl)methyl]cyclopentanamine

N-[(3-propan-2-ylphenyl)methyl]cyclopentanamine (PubChem CID 126684599) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is N-[(3-propan-2-ylphenyl)methyl]cyclopentanamine.

Molecular Properties

Compound NameN-[(3-propan-2-ylphenyl)methyl]cyclopentanamine
PubChem CID126684599
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC NameN-[(3-propan-2-ylphenyl)methyl]cyclopentanamine
SMILESCC(C)c1cccc(CNC2CCCC2)c1
InChIInChI=1S/C15H23N/c1-12(2)14-7-5-6-13(10-14)11-16-15-8-3-4-9-15/h5-7,10,12,15-16H,3-4,8-9,11H2,1-2H3
InChIKeyGLNAIKXMOWUQEB-UHFFFAOYSA-N
XLogP3.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(3-propan-2-ylphenyl)methyl]cyclopropanamine
CID 63886935
N-[(4-propan-2-ylphenyl)methyl]cycloheptanamine;hydrochloride
CID 17331879
N-[(3-cyclopropylphenyl)methyl]cyclopentanamine
CID 79979605
2-[3-[(3-propan-2-ylphenyl)methylamino]cyclobutyl]acetic acid
CID 138056035
N-[[3-(methoxymethyl)phenyl]methyl]cyclooctanamine
CID 54896500
N-[[3-(methoxymethyl)phenyl]methyl]cyclohexanamine
CID 54896835
N-[(3-propoxyphenyl)methyl]cycloheptanamine
CID 29222103
N-[(4-propan-2-ylphenyl)methyl]cyclopropanamine
CID 4723387
3-[(cyclobutylamino)methyl]phenol
CID 62416890
benzene;N-benzylcyclohexanamine
CID 142622843
4,4-dimethyl-N-[(4-propan-2-ylphenyl)methyl]cycloheptan-1-amine
CID 65083512
N-[(3-methylphenyl)methyl]cyclopentanamine;oxalic acid
CID 163327213

Frequently Asked Questions

What is the IUPAC name of N-[(3-propan-2-ylphenyl)methyl]cyclopentanamine?
The IUPAC name of N-[(3-propan-2-ylphenyl)methyl]cyclopentanamine (CID 126684599) is N-[(3-propan-2-ylphenyl)methyl]cyclopentanamine.
What is the SMILES notation for N-[(3-propan-2-ylphenyl)methyl]cyclopentanamine?
The canonical SMILES for N-[(3-propan-2-ylphenyl)methyl]cyclopentanamine is CC(C)c1cccc(CNC2CCCC2)c1.
What is the InChIKey of N-[(3-propan-2-ylphenyl)methyl]cyclopentanamine?
The InChIKey is GLNAIKXMOWUQEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-12(2)14-7-5-6-13(10-14)11-16-15-8-3-4-9-15/h5-7,10,12,15-16H,3-4,8-9,11H2,1-2H3.
What are the key properties of N-[(3-propan-2-ylphenyl)methyl]cyclopentanamine?
N-[(3-propan-2-ylphenyl)methyl]cyclopentanamine has a molecular weight of 217.36 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-propan-2-ylphenyl)methyl]cyclopentanamine is sourced from PubChem (CID 126684599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).