3-(carbamoylamino)-N-cyclopropylbenzamide

C11H13N3O2 — CID 9210111

IUPAC3-(carbamoylamino)-N-cyclopropylbenzamide
SMILESNC(=O)Nc1cccc(C(=O)NC2CC2)c1
InChIInChI=1S/C11H13N3O2/c12-11(16)14-9-3-1-2-7(6-9)10(15)13-8-4-5-8/h1-3,6,8H,4-5H2,(H,13,15)(H3,12,14,16)
InChIKeyGVHYVECTJYOABD-UHFFFAOYSA-N
MW219.24 g/mol
LogP1.07
Rot. Bonds3

About 3-(carbamoylamino)-N-cyclopropylbenzamide

3-(carbamoylamino)-N-cyclopropylbenzamide (PubChem CID 9210111) has the molecular formula C11H13N3O2 and a molecular weight of 219.24 g/mol. Its IUPAC name is 3-(carbamoylamino)-N-cyclopropylbenzamide.

Molecular Properties

Compound Name3-(carbamoylamino)-N-cyclopropylbenzamide
PubChem CID9210111
Molecular FormulaC11H13N3O2
Molecular Weight219.24 g/mol
Exact Mass219.10
IUPAC Name3-(carbamoylamino)-N-cyclopropylbenzamide
SMILESNC(=O)Nc1cccc(C(=O)NC2CC2)c1
InChIInChI=1S/C11H13N3O2/c12-11(16)14-9-3-1-2-7(6-9)10(15)13-8-4-5-8/h1-3,6,8H,4-5H2,(H,13,15)(H3,12,14,16)
InChIKeyGVHYVECTJYOABD-UHFFFAOYSA-N
XLogP1.07
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 51.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-3-(cyclopropylamino)benzamide
CID 103438850
N-(1-benzylpiperidin-4-yl)-3-(carbamoylamino)benzamide
CID 29206704
3-[[(2S)-2-aminopropanoyl]amino]-N-cyclopropylbenzamide
CID 78969031
3-acetamido-N-(4-hydroxycyclohexyl)benzamide
CID 43389328
3-(cyclopropanecarbonylamino)-N-[3-(cyclopropylcarbamoyl)phenyl]benzamide
CID 30127139
N-(4-aminocyclohexyl)-3-(cyclopropanecarbonylamino)benzamide
CID 119477045
2-amino-N-[3-(cyclopropylcarbamoyl)phenyl]butanediamide
CID 61252820
N-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide
CID 16567528
methyl 3-[[3-(cyclopropylcarbamoyl)benzoyl]amino]benzoate
CID 109050811
3-[(4-tert-butylbenzoyl)amino]-N-cyclopropylbenzamide
CID 26110808
3-[(2-cyanoacetyl)amino]-N-cyclopropylbenzamide
CID 168520744
N-[2-(aminomethyl)cyclopentyl]-3-(carbamoylamino)benzamide
CID 119601722

Frequently Asked Questions

What is the IUPAC name of 3-(carbamoylamino)-N-cyclopropylbenzamide?
The IUPAC name of 3-(carbamoylamino)-N-cyclopropylbenzamide (CID 9210111) is 3-(carbamoylamino)-N-cyclopropylbenzamide.
What is the SMILES notation for 3-(carbamoylamino)-N-cyclopropylbenzamide?
The canonical SMILES for 3-(carbamoylamino)-N-cyclopropylbenzamide is NC(=O)Nc1cccc(C(=O)NC2CC2)c1.
What is the InChIKey of 3-(carbamoylamino)-N-cyclopropylbenzamide?
The InChIKey is GVHYVECTJYOABD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2/c12-11(16)14-9-3-1-2-7(6-9)10(15)13-8-4-5-8/h1-3,6,8H,4-5H2,(H,13,15)(H3,12,14,16).
What are the key properties of 3-(carbamoylamino)-N-cyclopropylbenzamide?
3-(carbamoylamino)-N-cyclopropylbenzamide has a molecular weight of 219.24 g/mol, XLogP of 1.07, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(carbamoylamino)-N-cyclopropylbenzamide is sourced from PubChem (CID 9210111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).