N-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide

C12H13Cl2N3O2 — CID 47133418

IUPACN-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide
SMILESO=C(CNC(=O)Nc1cccc(Cl)c1Cl)NC1CC1
InChIInChI=1S/C12H13Cl2N3O2/c13-8-2-1-3-9(11(8)14)17-12(19)15-6-10(18)16-7-4-5-7/h1-3,7H,4-6H2,(H,16,18)(H2,15,17,19)
InChIKeyQOXCASLKZOLRHT-UHFFFAOYSA-N
MW302.16 g/mol
LogP2.39
Rot. Bonds4

About N-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide

N-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide (PubChem CID 47133418) has the molecular formula C12H13Cl2N3O2 and a molecular weight of 302.16 g/mol. Its IUPAC name is N-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide
PubChem CID47133418
Molecular FormulaC12H13Cl2N3O2
Molecular Weight302.16 g/mol
Exact Mass301.04
IUPAC NameN-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide
SMILESO=C(CNC(=O)Nc1cccc(Cl)c1Cl)NC1CC1
InChIInChI=1S/C12H13Cl2N3O2/c13-8-2-1-3-9(11(8)14)17-12(19)15-6-10(18)16-7-4-5-7/h1-3,7H,4-6H2,(H,16,18)(H2,15,17,19)
InChIKeyQOXCASLKZOLRHT-UHFFFAOYSA-N
XLogP2.39
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.16
LogP ≤ 52.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2,3-dichlorophenyl)carbamoylamino]acetic acid
CID 28508177
2-(2,3-dichloroanilino)-N-(4-methylcyclohexyl)acetamide
CID 47123114
N-(1-acetylpiperidin-4-yl)-2-(2,3-dichloroanilino)acetamide
CID 86910665
N-(2,3-dichlorophenyl)cyclopropanecarboxamide
CID 4652086
N-cyclohexyl-2-[2-(2,3-dichloroanilino)-2-oxoethoxy]acetamide
CID 5116287
1-(2,3-dichlorophenyl)-3-prop-2-ynylurea
CID 97180602
1-(2-cyclohexylethyl)-3-(2,3-dichlorophenyl)urea
CID 108888463
N-[2-(2,3-dichloroanilino)-2-oxoethyl]oxane-4-carboxamide
CID 113001519
4-[[2-(cyclopropylamino)-2-oxoethyl]carbamoylamino]-3-hydroxybenzoic acid
CID 61202694
1-(2,3-dichlorophenyl)-3-propylurea
CID 4654956
2-(cyclopropylmethylamino)-N-(2,3-dichlorophenyl)acetamide
CID 60843168
2-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-N-cyclopropylacetamide
CID 84515951

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide?
The IUPAC name of N-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide (CID 47133418) is N-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide is O=C(CNC(=O)Nc1cccc(Cl)c1Cl)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide?
The InChIKey is QOXCASLKZOLRHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13Cl2N3O2/c13-8-2-1-3-9(11(8)14)17-12(19)15-6-10(18)16-7-4-5-7/h1-3,7H,4-6H2,(H,16,18)(H2,15,17,19).
What are the key properties of N-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide?
N-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide has a molecular weight of 302.16 g/mol, XLogP of 2.39, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(2,3-dichlorophenyl)carbamoylamino]acetamide is sourced from PubChem (CID 47133418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).