N-(cyclobutylmethyl)-4-(propylamino)benzamide

C15H22N2O — CID 62170357

IUPACN-(cyclobutylmethyl)-4-(propylamino)benzamide
SMILESCCCNc1ccc(C(=O)NCC2CCC2)cc1
InChIInChI=1S/C15H22N2O/c1-2-10-16-14-8-6-13(7-9-14)15(18)17-11-12-4-3-5-12/h6-9,12,16H,2-5,10-11H2,1H3,(H,17,18)
InChIKeyJCBDXBLVMWFPBZ-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.04
Rot. Bonds6

About N-(cyclobutylmethyl)-4-(propylamino)benzamide

N-(cyclobutylmethyl)-4-(propylamino)benzamide (PubChem CID 62170357) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-4-(propylamino)benzamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-4-(propylamino)benzamide
PubChem CID62170357
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-(cyclobutylmethyl)-4-(propylamino)benzamide
SMILESCCCNc1ccc(C(=O)NCC2CCC2)cc1
InChIInChI=1S/C15H22N2O/c1-2-10-16-14-8-6-13(7-9-14)15(18)17-11-12-4-3-5-12/h6-9,12,16H,2-5,10-11H2,1H3,(H,17,18)
InChIKeyJCBDXBLVMWFPBZ-UHFFFAOYSA-N
XLogP3.04
TPSA41.13 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 ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyclohexylethyl)-4-(propylamino)benzamide
CID 62180221
N-[(1-methylpyrrolidin-3-yl)methyl]-4-(propylamino)benzamide
CID 62180024
N-(3-cyclopentylpropyl)-4-(propylamino)benzamide
CID 106015559
N-(cyclopropylmethyl)-4-(ethylamino)benzamide
CID 62173113
N-[(2-methylcyclohexyl)methyl]-4-(propylamino)benzamide
CID 62181510
N-cyclobutyl-4-(propylamino)benzamide
CID 55067083
N-(cyclobutylmethyl)-6-(propylamino)pyridine-3-carboxamide
CID 62168464
N-cyclooctyl-4-(propylamino)benzamide
CID 62172072
4-acetamido-N-(cyclohexylmethyl)benzamide
CID 2096141
4-(ethylamino)-N-[(3-methylcyclopentyl)methyl]benzamide
CID 107415191
N-(2-methylcyclopentyl)-4-(propylamino)benzamide
CID 63279400
4-(ethylamino)-N-(oxan-3-ylmethyl)benzamide
CID 62175319

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-4-(propylamino)benzamide?
The IUPAC name of N-(cyclobutylmethyl)-4-(propylamino)benzamide (CID 62170357) is N-(cyclobutylmethyl)-4-(propylamino)benzamide.
What is the SMILES notation for N-(cyclobutylmethyl)-4-(propylamino)benzamide?
The canonical SMILES for N-(cyclobutylmethyl)-4-(propylamino)benzamide is CCCNc1ccc(C(=O)NCC2CCC2)cc1.
What is the InChIKey of N-(cyclobutylmethyl)-4-(propylamino)benzamide?
The InChIKey is JCBDXBLVMWFPBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-2-10-16-14-8-6-13(7-9-14)15(18)17-11-12-4-3-5-12/h6-9,12,16H,2-5,10-11H2,1H3,(H,17,18).
What are the key properties of N-(cyclobutylmethyl)-4-(propylamino)benzamide?
N-(cyclobutylmethyl)-4-(propylamino)benzamide has a molecular weight of 246.35 g/mol, XLogP of 3.04, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-4-(propylamino)benzamide is sourced from PubChem (CID 62170357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).