N-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide

C17H26N2O — CID 107400011

IUPACN-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide
SMILESCCN(CC1CCC1)C(=O)c1ccccc1NC(C)C
InChIInChI=1S/C17H26N2O/c1-4-19(12-14-8-7-9-14)17(20)15-10-5-6-11-16(15)18-13(2)3/h5-6,10-11,13-14,18H,4,7-9,12H2,1-3H3
InChIKeyGLDLWWATHCSYSS-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.77
Rot. Bonds6

About N-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide

N-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide (PubChem CID 107400011) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide
PubChem CID107400011
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide
SMILESCCN(CC1CCC1)C(=O)c1ccccc1NC(C)C
InChIInChI=1S/C17H26N2O/c1-4-19(12-14-8-7-9-14)17(20)15-10-5-6-11-16(15)18-13(2)3/h5-6,10-11,13-14,18H,4,7-9,12H2,1-3H3
InChIKeyGLDLWWATHCSYSS-UHFFFAOYSA-N
XLogP3.77
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide
CID 55177665
2-[cyclobutylmethyl(ethyl)carbamoyl]benzoic acid
CID 107397528
N-ethyl-N-(2-hydroxy-2-methylpropyl)-2-(propan-2-ylamino)benzamide
CID 79378834
N-ethyl-N-(2-methylprop-2-enyl)-2-(propan-2-ylamino)benzamide
CID 63107590
2-[[cyclobutylmethyl(ethyl)carbamoyl]amino]benzoic acid
CID 107400204
N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide
CID 63107544
N-cyclopropyl-2-(propan-2-ylamino)-N-(2,2,2-trifluoroethyl)benzamide
CID 63108556
N-(cyclobutylmethyl)-N-ethyl-3-hydrazinylpyridine-4-carboxamide
CID 107401447
N-[(1-methylpiperidin-3-yl)methyl]-2-(propan-2-ylamino)benzamide
CID 63108415
N-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide
CID 107401376
N-ethyl-2-(propan-2-ylamino)benzamide
CID 63107552
N-(cyclopentylmethyl)-2-hydrazinyl-N-methylbenzamide
CID 63656583

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide?
The IUPAC name of N-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide (CID 107400011) is N-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide.
What is the SMILES notation for N-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide?
The canonical SMILES for N-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide is CCN(CC1CCC1)C(=O)c1ccccc1NC(C)C.
What is the InChIKey of N-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide?
The InChIKey is GLDLWWATHCSYSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-4-19(12-14-8-7-9-14)17(20)15-10-5-6-11-16(15)18-13(2)3/h5-6,10-11,13-14,18H,4,7-9,12H2,1-3H3.
What are the key properties of N-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide?
N-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide has a molecular weight of 274.41 g/mol, XLogP of 3.77, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide is sourced from PubChem (CID 107400011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).