N-cyclopropyl-4-[[3-(4-methylphenyl)cyclobutyl]amino]butanamide

C18H26N2O — CID 79378064

IUPACN-cyclopropyl-4-[[3-(4-methylphenyl)cyclobutyl]amino]butanamide
SMILESCc1ccc(C2CC(NCCCC(=O)NC3CC3)C2)cc1
InChIInChI=1S/C18H26N2O/c1-13-4-6-14(7-5-13)15-11-17(12-15)19-10-2-3-18(21)20-16-8-9-16/h4-7,15-17,19H,2-3,8-12H2,1H3,(H,20,21)
InChIKeyGSODCBFFRPUHDM-UHFFFAOYSA-N
MW286.42 g/mol
LogP2.89
Rot. Bonds7

About N-cyclopropyl-4-[[3-(4-methylphenyl)cyclobutyl]amino]butanamide

N-cyclopropyl-4-[[3-(4-methylphenyl)cyclobutyl]amino]butanamide (PubChem CID 79378064) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-cyclopropyl-4-[[3-(4-methylphenyl)cyclobutyl]amino]butanamide.

Molecular Properties

Compound NameN-cyclopropyl-4-[[3-(4-methylphenyl)cyclobutyl]amino]butanamide
PubChem CID79378064
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-cyclopropyl-4-[[3-(4-methylphenyl)cyclobutyl]amino]butanamide
SMILESCc1ccc(C2CC(NCCCC(=O)NC3CC3)C2)cc1
InChIInChI=1S/C18H26N2O/c1-13-4-6-14(7-5-13)15-11-17(12-15)19-10-2-3-18(21)20-16-8-9-16/h4-7,15-17,19H,2-3,8-12H2,1H3,(H,20,21)
InChIKeyGSODCBFFRPUHDM-UHFFFAOYSA-N
XLogP2.89
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-cyclopropyl-3-[(3-phenylcyclobutyl)amino]propanamide
CID 79386458
N-butyl-3-(4-methylphenyl)cyclobutan-1-amine
CID 43633076
N-cyclopropyl-3-[(4-methylphenyl)methylamino]propanamide
CID 55090993
4-[[2-amino-2-(4-methylphenyl)acetyl]amino]-N-cyclopropylbutanamide
CID 106151335
3-[[[3-(4-methylphenyl)cyclobutyl]amino]methyl]cyclobutan-1-ol
CID 66005603
N-(7-methyloctyl)-3-(4-methylphenyl)cyclobutan-1-amine
CID 43634778
4-(methylamino)-N-(4-phenylcyclohexyl)butanamide;hydrochloride
CID 119716199
N-(3-methylbutyl)-3-(4-methylphenyl)cyclobutan-1-amine
CID 43633229
N-cyclopropyl-4-[(4,4-dimethylcyclohexyl)amino]butanamide
CID 79032428
N-cyclopropyl-4-[(4-ethylphenyl)methylamino]butanamide
CID 78922158
N-cyclopropyl-3-[[2-(4-methylanilino)-2-oxoethyl]amino]propanamide
CID 79394044
N-cyclopropyl-4-[(2-methyloxan-4-yl)amino]butanamide
CID 79393847

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[[3-(4-methylphenyl)cyclobutyl]amino]butanamide?
The IUPAC name of N-cyclopropyl-4-[[3-(4-methylphenyl)cyclobutyl]amino]butanamide (CID 79378064) is N-cyclopropyl-4-[[3-(4-methylphenyl)cyclobutyl]amino]butanamide.
What is the SMILES notation for N-cyclopropyl-4-[[3-(4-methylphenyl)cyclobutyl]amino]butanamide?
The canonical SMILES for N-cyclopropyl-4-[[3-(4-methylphenyl)cyclobutyl]amino]butanamide is Cc1ccc(C2CC(NCCCC(=O)NC3CC3)C2)cc1.
What is the InChIKey of N-cyclopropyl-4-[[3-(4-methylphenyl)cyclobutyl]amino]butanamide?
The InChIKey is GSODCBFFRPUHDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-13-4-6-14(7-5-13)15-11-17(12-15)19-10-2-3-18(21)20-16-8-9-16/h4-7,15-17,19H,2-3,8-12H2,1H3,(H,20,21).
What are the key properties of N-cyclopropyl-4-[[3-(4-methylphenyl)cyclobutyl]amino]butanamide?
N-cyclopropyl-4-[[3-(4-methylphenyl)cyclobutyl]amino]butanamide has a molecular weight of 286.42 g/mol, XLogP of 2.89, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[[3-(4-methylphenyl)cyclobutyl]amino]butanamide is sourced from PubChem (CID 79378064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).