4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide

C15H20N2O3 — CID 47422905

IUPAC4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide
SMILESCNC(=O)c1ccc(NC(=O)C(C)OCC2CC2)cc1
InChIInChI=1S/C15H20N2O3/c1-10(20-9-11-3-4-11)14(18)17-13-7-5-12(6-8-13)15(19)16-2/h5-8,10-11H,3-4,9H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyMHDYTJZYZHRCBY-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.80
Rot. Bonds6

About 4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide

4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide (PubChem CID 47422905) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide.

Molecular Properties

Compound Name4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide
PubChem CID47422905
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide
SMILESCNC(=O)c1ccc(NC(=O)C(C)OCC2CC2)cc1
InChIInChI=1S/C15H20N2O3/c1-10(20-9-11-3-4-11)14(18)17-13-7-5-12(6-8-13)15(19)16-2/h5-8,10-11H,3-4,9H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyMHDYTJZYZHRCBY-UHFFFAOYSA-N
XLogP1.80
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-[[(2S)-2-[[(2R)-oxolan-2-yl]methoxy]propanoyl]amino]benzamide
CID 95247449
5-[2-(cyclopropylmethoxy)propanoylamino]-2-fluoro-N-methylbenzamide
CID 49176640
N-(4-cyclopentylsulfonylphenyl)-2-(cyclopropylmethoxy)propanamide
CID 86847260
(2S)-N-(6-amino-3-pyridinyl)-2-(cyclopropylmethoxy)propanamide
CID 99776072
4-[[cyclopropyl-[(2S)-2-(cyclopropylmethoxy)propanoyl]amino]methyl]-N-methylbenzamide
CID 94823521
N-[3-chloro-4-(2-methoxyethoxy)phenyl]-2-(cyclopropylmethoxy)propanamide
CID 48500260
3-[[(2S)-2-(cyclopropylmethoxy)propanoyl]amino]-N-pyridin-4-ylbenzamide
CID 95383218
3-[[(2R)-2-(cyclopropylmethoxy)propanoyl]amino]-N-pyridin-4-ylbenzamide
CID 95383219
4-[[2-(cyclopropylmethylamino)acetyl]amino]-N-methylbenzamide
CID 60868348
N-methyl-4-(2-methylpentanoylamino)benzamide
CID 75981619
2-(cyclopropylmethoxy)-N-(2,2-dimethyl-1,3-benzodioxol-5-yl)propanamide
CID 47079469
4-(1-cyclopropylpropan-2-ylamino)-N-methylbenzamide
CID 113489746

Frequently Asked Questions

What is the IUPAC name of 4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide?
The IUPAC name of 4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide (CID 47422905) is 4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide.
What is the SMILES notation for 4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide?
The canonical SMILES for 4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide is CNC(=O)c1ccc(NC(=O)C(C)OCC2CC2)cc1.
What is the InChIKey of 4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide?
The InChIKey is MHDYTJZYZHRCBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-10(20-9-11-3-4-11)14(18)17-13-7-5-12(6-8-13)15(19)16-2/h5-8,10-11H,3-4,9H2,1-2H3,(H,16,19)(H,17,18).
What are the key properties of 4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide?
4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide has a molecular weight of 276.34 g/mol, XLogP of 1.80, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(cyclopropylmethoxy)propanoylamino]-N-methylbenzamide is sourced from PubChem (CID 47422905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).