N-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide

C18H28N2O — CID 107401376

IUPACN-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide
SMILESCCCNc1cc(C)ccc1C(=O)N(CC)CC1CCC1
InChIInChI=1S/C18H28N2O/c1-4-11-19-17-12-14(3)9-10-16(17)18(21)20(5-2)13-15-7-6-8-15/h9-10,12,15,19H,4-8,11,13H2,1-3H3
InChIKeyXNFVITNIDSXBEB-UHFFFAOYSA-N
MW288.44 g/mol
LogP4.08
Rot. Bonds7

About N-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide

N-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide (PubChem CID 107401376) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide
PubChem CID107401376
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC NameN-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide
SMILESCCCNc1cc(C)ccc1C(=O)N(CC)CC1CCC1
InChIInChI=1S/C18H28N2O/c1-4-11-19-17-12-14(3)9-10-16(17)18(21)20(5-2)13-15-7-6-8-15/h9-10,12,15,19H,4-8,11,13H2,1-3H3
InChIKeyXNFVITNIDSXBEB-UHFFFAOYSA-N
XLogP4.08
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide
CID 62509873
4-methyl-N-[(3-methylcyclopentyl)methyl]-2-(propylamino)benzamide
CID 107415255
N-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide
CID 107400011
N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide
CID 63940110
N-ethyl-5-methyl-N-(2-methylpropyl)-2-(propylamino)benzamide
CID 62509850
4-methyl-2-(propylamino)-N-(thiolan-2-ylmethyl)benzamide
CID 80586222
N-(cyclobutylmethyl)-N-ethyl-4-fluoro-2-hydroxybenzamide
CID 107399082
N,N-diethyl-2-(propylamino)benzamide
CID 62171276
N-(cyclobutylmethyl)-N-ethyl-3-hydrazinylpyridine-4-carboxamide
CID 107401447
2-[cyclobutylmethyl(ethyl)carbamoyl]benzoic acid
CID 107397528
4-methyl-N-piperidin-1-yl-2-(propylamino)benzamide
CID 83025152
N-(cyclopropylmethyl)-2-hydrazinyl-5-methyl-N-propylbenzamide
CID 62511311

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide?
The IUPAC name of N-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide (CID 107401376) is N-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide.
What is the SMILES notation for N-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide?
The canonical SMILES for N-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide is CCCNc1cc(C)ccc1C(=O)N(CC)CC1CCC1.
What is the InChIKey of N-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide?
The InChIKey is XNFVITNIDSXBEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-4-11-19-17-12-14(3)9-10-16(17)18(21)20(5-2)13-15-7-6-8-15/h9-10,12,15,19H,4-8,11,13H2,1-3H3.
What are the key properties of N-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide?
N-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide has a molecular weight of 288.44 g/mol, XLogP of 4.08, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide is sourced from PubChem (CID 107401376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).