2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide

C19H20N4O3 — CID 78793094

IUPAC2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide
SMILESNC(=O)c1ccc(NCC(=O)Nc2ccccc2C(=O)NC2CC2)cc1
InChIInChI=1S/C19H20N4O3/c20-18(25)12-5-7-13(8-6-12)21-11-17(24)23-16-4-2-1-3-15(16)19(26)22-14-9-10-14/h1-8,14,21H,9-11H2,(H2,20,25)(H,22,26)(H,23,24)
InChIKeyLFNCYACGTJOBDP-UHFFFAOYSA-N
MW352.39 g/mol
LogP1.73
Rot. Bonds7

About 2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide

2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide (PubChem CID 78793094) has the molecular formula C19H20N4O3 and a molecular weight of 352.39 g/mol. Its IUPAC name is 2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide.

Molecular Properties

Compound Name2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide
PubChem CID78793094
Molecular FormulaC19H20N4O3
Molecular Weight352.39 g/mol
Exact Mass352.15
IUPAC Name2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide
SMILESNC(=O)c1ccc(NCC(=O)Nc2ccccc2C(=O)NC2CC2)cc1
InChIInChI=1S/C19H20N4O3/c20-18(25)12-5-7-13(8-6-12)21-11-17(24)23-16-4-2-1-3-15(16)19(26)22-14-9-10-14/h1-8,14,21H,9-11H2,(H2,20,25)(H,22,26)(H,23,24)
InChIKeyLFNCYACGTJOBDP-UHFFFAOYSA-N
XLogP1.73
TPSA113.32 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 51.73
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2-[[2-[4-[(2-fluorophenyl)methylcarbamoyl]anilino]acetyl]amino]benzamide
CID 55898312
2-[[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]amino]-N-cyclopropylbenzamide
CID 18144272
2-[[2-[4-(cyclohexylcarbamoyl)anilino]-2-oxoethyl]amino]benzamide
CID 54811917
N-cyclopropyl-2-[[2-[3-(trifluoromethyl)anilino]acetyl]amino]benzamide
CID 25353415
N-cyclopropyl-2-[[2-oxo-2-(4-phenylanilino)ethyl]amino]benzamide
CID 24614903
N-cyclopropyl-2-[[2-(2,5-dimethylanilino)acetyl]amino]benzamide
CID 17498144
N-cyclopropyl-2-[[2-[3-(morpholine-4-carbonyl)anilino]acetyl]amino]benzamide
CID 55898533
2-[[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]amino]-5-piperidin-1-ylbenzamide
CID 18272466
N-cyclopropyl-2-[[4-(4-methylphenyl)-4-oxobutanoyl]amino]benzamide
CID 34279897
N-cyclopropyl-2-[[2-(prop-2-enylamino)acetyl]amino]benzamide
CID 78908313
2-[[2-(3-carbamoylanilino)acetyl]amino]benzamide
CID 54842453
2-(butanoylamino)-N-cyclopropylbenzamide
CID 31824279

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide?
The IUPAC name of 2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide (CID 78793094) is 2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide.
What is the SMILES notation for 2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide?
The canonical SMILES for 2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide is NC(=O)c1ccc(NCC(=O)Nc2ccccc2C(=O)NC2CC2)cc1.
What is the InChIKey of 2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide?
The InChIKey is LFNCYACGTJOBDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O3/c20-18(25)12-5-7-13(8-6-12)21-11-17(24)23-16-4-2-1-3-15(16)19(26)22-14-9-10-14/h1-8,14,21H,9-11H2,(H2,20,25)(H,22,26)(H,23,24).
What are the key properties of 2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide?
2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide has a molecular weight of 352.39 g/mol, XLogP of 1.73, 7 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(4-carbamoylanilino)acetyl]amino]-N-cyclopropylbenzamide is sourced from PubChem (CID 78793094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).