N-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide

C15H22N2O — CID 66004709

IUPACN-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide
SMILESNC1CC(CNC(=O)CCCc2ccccc2)C1
InChIInChI=1S/C15H22N2O/c16-14-9-13(10-14)11-17-15(18)8-4-7-12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-11,16H2,(H,17,18)
InChIKeyQANJTOIAKOUOSU-UHFFFAOYSA-N
MW246.35 g/mol
LogP1.86
Rot. Bonds6

About N-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide

N-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide (PubChem CID 66004709) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide.

Molecular Properties

Compound NameN-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide
PubChem CID66004709
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide
SMILESNC1CC(CNC(=O)CCCc2ccccc2)C1
InChIInChI=1S/C15H22N2O/c16-14-9-13(10-14)11-17-15(18)8-4-7-12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-11,16H2,(H,17,18)
InChIKeyQANJTOIAKOUOSU-UHFFFAOYSA-N
XLogP1.86
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide 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-(cyclopropylmethyl)-3-phenylpropanamide
CID 51076426
4-phenyl-N-[[(2R)-pyrrolidin-2-yl]methyl]butanamide
CID 11382839
N-[(3-hydroxycyclopentyl)methyl]-3-phenylpropanamide
CID 103279802
N-[(3-aminocyclobutyl)methyl]-3-(1-phenylpyrazol-4-yl)propanamide
CID 167759352
4-phenyl-N-[[(2R)-1-(2-phenylethyl)pyrrolidin-2-yl]methyl]butanamide
CID 11385742
1-(3-aminoazetidin-1-yl)-4-phenylbutan-1-one
CID 63753831
4-phenyl-N-(2-phenylethyl)butanamide;propane
CID 143447835
N-(morpholin-3-ylmethyl)-4-phenylbutanamide
CID 103548407
4-phenyl-N-prop-2-ynylbutanamide
CID 60769101
3-amino-N-[[1-(4-phenylbutanoyl)piperidin-2-yl]methyl]propanamide
CID 120579429
N-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide
CID 55771489
(2S)-2-hydroxy-3-(4-phenylbutanoylamino)propanoic acid
CID 114006473

Frequently Asked Questions

What is the IUPAC name of N-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide?
The IUPAC name of N-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide (CID 66004709) is N-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide.
What is the SMILES notation for N-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide?
The canonical SMILES for N-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide is NC1CC(CNC(=O)CCCc2ccccc2)C1.
What is the InChIKey of N-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide?
The InChIKey is QANJTOIAKOUOSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c16-14-9-13(10-14)11-17-15(18)8-4-7-12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-11,16H2,(H,17,18).
What are the key properties of N-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide?
N-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide has a molecular weight of 246.35 g/mol, XLogP of 1.86, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-aminocyclobutyl)methyl]-4-phenylbutanamide is sourced from PubChem (CID 66004709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).