N-[(4-butylphenyl)methyl]cyclobutanamine

C15H23N — CID 98783334

IUPACN-[(4-butylphenyl)methyl]cyclobutanamine
SMILESCCCCc1ccc(CNC2CCC2)cc1
InChIInChI=1S/C15H23N/c1-2-3-5-13-8-10-14(11-9-13)12-16-15-6-4-7-15/h8-11,15-16H,2-7,12H2,1H3
InChIKeySOROQGUMBSNBPB-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.67
Rot. Bonds6

About N-[(4-butylphenyl)methyl]cyclobutanamine

N-[(4-butylphenyl)methyl]cyclobutanamine (PubChem CID 98783334) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is N-[(4-butylphenyl)methyl]cyclobutanamine.

Molecular Properties

Compound NameN-[(4-butylphenyl)methyl]cyclobutanamine
PubChem CID98783334
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC NameN-[(4-butylphenyl)methyl]cyclobutanamine
SMILESCCCCc1ccc(CNC2CCC2)cc1
InChIInChI=1S/C15H23N/c1-2-3-5-13-8-10-14(11-9-13)12-16-15-6-4-7-15/h8-11,15-16H,2-7,12H2,1H3
InChIKeySOROQGUMBSNBPB-UHFFFAOYSA-N
XLogP3.67
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[(4-butylphenyl)methyl]cyclobutanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(4-butylphenyl)methyl]cyclohexanamine
CID 70837938
N-[(4-propylphenyl)methyl]cyclohexanamine
CID 94685509
1-N,2-N-bis[(4-butylphenyl)methyl]cyclohexane-1,2-diamine
CID 51040392
N-[[4-[(4-butylphenyl)methoxy]phenyl]methyl]piperidin-4-amine
CID 135174811
N-[(4-octoxyphenyl)methyl]cyclopropanamine
CID 43213779
N-[2-(4-butylphenoxy)ethyl]cycloheptanamine
CID 115493422
N-[(4-fluorophenyl)methyl]-4-methylcycloheptan-1-amine
CID 65081377
N-[(4-butoxyphenyl)methyl]-4-ethylcyclohexan-1-amine
CID 63453718
4-butyl-N-(3-methylcyclohexyl)aniline
CID 43103232
N-(4-butylphenyl)-4-ethylcycloheptan-1-amine
CID 65082977
4-[(cyclopentylamino)methyl]phenol
CID 3873791
N-[(4-tert-butylphenyl)methyl]cycloheptanamine
CID 28509997

Frequently Asked Questions

What is the IUPAC name of N-[(4-butylphenyl)methyl]cyclobutanamine?
The IUPAC name of N-[(4-butylphenyl)methyl]cyclobutanamine (CID 98783334) is N-[(4-butylphenyl)methyl]cyclobutanamine.
What is the SMILES notation for N-[(4-butylphenyl)methyl]cyclobutanamine?
The canonical SMILES for N-[(4-butylphenyl)methyl]cyclobutanamine is CCCCc1ccc(CNC2CCC2)cc1.
What is the InChIKey of N-[(4-butylphenyl)methyl]cyclobutanamine?
The InChIKey is SOROQGUMBSNBPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-2-3-5-13-8-10-14(11-9-13)12-16-15-6-4-7-15/h8-11,15-16H,2-7,12H2,1H3.
What are the key properties of N-[(4-butylphenyl)methyl]cyclobutanamine?
N-[(4-butylphenyl)methyl]cyclobutanamine has a molecular weight of 217.36 g/mol, XLogP of 3.67, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-butylphenyl)methyl]cyclobutanamine is sourced from PubChem (CID 98783334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).