3-[[2-[(3-chlorobenzoyl)amino]acetyl]amino]-N-cyclopropylbenzamide

C19H18ClN3O3 — CID 26110931

IUPAC3-[[2-[(3-chlorobenzoyl)amino]acetyl]amino]-N-cyclopropylbenzamide
SMILESO=C(CNC(=O)c1cccc(Cl)c1)Nc1cccc(C(=O)NC2CC2)c1
InChIInChI=1S/C19H18ClN3O3/c20-14-5-1-3-12(9-14)18(25)21-11-17(24)22-16-6-2-4-13(10-16)19(26)23-15-7-8-15/h1-6,9-10,15H,7-8,11H2,(H,21,25)(H,22,24)(H,23,26)
InChIKeyIXHPJMGNLSAOHH-UHFFFAOYSA-N
MW371.82 g/mol
LogP2.60
Rot. Bonds6

About 3-[[2-[(3-chlorobenzoyl)amino]acetyl]amino]-N-cyclopropylbenzamide

3-[[2-[(3-chlorobenzoyl)amino]acetyl]amino]-N-cyclopropylbenzamide (PubChem CID 26110931) has the molecular formula C19H18ClN3O3 and a molecular weight of 371.82 g/mol. Its IUPAC name is 3-[[2-[(3-chlorobenzoyl)amino]acetyl]amino]-N-cyclopropylbenzamide.

Molecular Properties

Compound Name3-[[2-[(3-chlorobenzoyl)amino]acetyl]amino]-N-cyclopropylbenzamide
PubChem CID26110931
Molecular FormulaC19H18ClN3O3
Molecular Weight371.82 g/mol
Exact Mass371.10
IUPAC Name3-[[2-[(3-chlorobenzoyl)amino]acetyl]amino]-N-cyclopropylbenzamide
SMILESO=C(CNC(=O)c1cccc(Cl)c1)Nc1cccc(C(=O)NC2CC2)c1
InChIInChI=1S/C19H18ClN3O3/c20-14-5-1-3-12(9-14)18(25)21-11-17(24)22-16-6-2-4-13(10-16)19(26)23-15-7-8-15/h1-6,9-10,15H,7-8,11H2,(H,21,25)(H,22,24)(H,23,26)
InChIKeyIXHPJMGNLSAOHH-UHFFFAOYSA-N
XLogP2.60
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.82
LogP ≤ 52.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-3-[[2-[(2-phenylacetyl)amino]acetyl]amino]benzamide
CID 26110998
3-chloro-N-[2-(3-methylanilino)-2-oxoethyl]benzamide
CID 772080
3-[(3-chlorobenzoyl)amino]-N-cyclohexylbenzamide
CID 17170567
3-chloro-N-[2-[4-(cyclopropanecarbonylamino)anilino]-2-oxoethyl]benzamide
CID 26058931
3-chloro-N-[2-[3-(hydroxymethyl)anilino]-2-oxoethyl]benzamide
CID 47005544
3-[[2-(tert-butylamino)acetyl]amino]-N-cyclopropylbenzamide
CID 17415806
3-chloro-N-[2-(3-cyanoanilino)-2-oxoethyl]benzamide
CID 9245643
3-[(2-cyanoacetyl)amino]-N-cyclopropylbenzamide
CID 168520744
N-(4-aminocyclohexyl)-3-chlorobenzamide
CID 62313478
2-chloro-4-[[2-[3-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]amino]benzamide
CID 33006842
3-chloro-N-[2-oxo-2-[3-(trifluoromethoxy)anilino]ethyl]benzamide
CID 38033870
3-[4-(4-chlorophenyl)sulfanylbutanoylamino]-N-cyclopropylbenzamide
CID 26993661

Frequently Asked Questions

What is the IUPAC name of 3-[[2-[(3-chlorobenzoyl)amino]acetyl]amino]-N-cyclopropylbenzamide?
The IUPAC name of 3-[[2-[(3-chlorobenzoyl)amino]acetyl]amino]-N-cyclopropylbenzamide (CID 26110931) is 3-[[2-[(3-chlorobenzoyl)amino]acetyl]amino]-N-cyclopropylbenzamide.
What is the SMILES notation for 3-[[2-[(3-chlorobenzoyl)amino]acetyl]amino]-N-cyclopropylbenzamide?
The canonical SMILES for 3-[[2-[(3-chlorobenzoyl)amino]acetyl]amino]-N-cyclopropylbenzamide is O=C(CNC(=O)c1cccc(Cl)c1)Nc1cccc(C(=O)NC2CC2)c1.
What is the InChIKey of 3-[[2-[(3-chlorobenzoyl)amino]acetyl]amino]-N-cyclopropylbenzamide?
The InChIKey is IXHPJMGNLSAOHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN3O3/c20-14-5-1-3-12(9-14)18(25)21-11-17(24)22-16-6-2-4-13(10-16)19(26)23-15-7-8-15/h1-6,9-10,15H,7-8,11H2,(H,21,25)(H,22,24)(H,23,26).
What are the key properties of 3-[[2-[(3-chlorobenzoyl)amino]acetyl]amino]-N-cyclopropylbenzamide?
3-[[2-[(3-chlorobenzoyl)amino]acetyl]amino]-N-cyclopropylbenzamide has a molecular weight of 371.82 g/mol, XLogP of 2.60, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-[(3-chlorobenzoyl)amino]acetyl]amino]-N-cyclopropylbenzamide is sourced from PubChem (CID 26110931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).