5-amino-2-chloro-N-cyclopropyl-N-methylbenzamide

C11H13ClN2O — CID 43264488

IUPAC5-amino-2-chloro-N-cyclopropyl-N-methylbenzamide
SMILESCN(C(=O)c1cc(N)ccc1Cl)C1CC1
InChIInChI=1S/C11H13ClN2O/c1-14(8-3-4-8)11(15)9-6-7(13)2-5-10(9)12/h2,5-6,8H,3-4,13H2,1H3
InChIKeyUMMRMEXDBJBYLN-UHFFFAOYSA-N
MW224.69 g/mol
LogP2.16
Rot. Bonds2

About 5-amino-2-chloro-N-cyclopropyl-N-methylbenzamide

5-amino-2-chloro-N-cyclopropyl-N-methylbenzamide (PubChem CID 43264488) has the molecular formula C11H13ClN2O and a molecular weight of 224.69 g/mol. Its IUPAC name is 5-amino-2-chloro-N-cyclopropyl-N-methylbenzamide.

Molecular Properties

Compound Name5-amino-2-chloro-N-cyclopropyl-N-methylbenzamide
PubChem CID43264488
Molecular FormulaC11H13ClN2O
Molecular Weight224.69 g/mol
Exact Mass224.07
IUPAC Name5-amino-2-chloro-N-cyclopropyl-N-methylbenzamide
SMILESCN(C(=O)c1cc(N)ccc1Cl)C1CC1
InChIInChI=1S/C11H13ClN2O/c1-14(8-3-4-8)11(15)9-6-7(13)2-5-10(9)12/h2,5-6,8H,3-4,13H2,1H3
InChIKeyUMMRMEXDBJBYLN-UHFFFAOYSA-N
XLogP2.16
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.69
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-amino-2-chloro-N-cyclopropyl-N-methylbenzamide;hydrochloride
CID 119722181
5-amino-N-cyclopentyl-N,2-dimethylbenzamide
CID 61291157
5-amino-N-cyclooctyl-N,2-dimethylbenzamide
CID 120629477
5-amino-N-cyclohexyl-2-fluoro-N-methylbenzamide
CID 43510713
4-amino-2-chloro-N-methyl-N-(1-propylpiperidin-4-yl)benzamide
CID 61139107
2,4-diamino-N-methyl-N-(oxan-4-yl)benzamide
CID 61102317
2,4-diamino-N-methyl-N-(1-methylpiperidin-4-yl)benzamide
CID 61092236
2-amino-3,5-dichloro-N-cyclohexyl-N-methylbenzamide
CID 69376073
5-chloro-N-cyclopropyl-2-hydrazinyl-N-methylbenzamide
CID 62243364
2-chloro-N-methyl-N-(4-methylcyclohexyl)-5-(propan-2-ylsulfamoyl)benzamide
CID 32916652
2-amino-4-bromo-N-cyclopropyl-N-methylbenzamide
CID 79714357
2,4-diamino-N-methyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide
CID 61105123

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-chloro-N-cyclopropyl-N-methylbenzamide?
The IUPAC name of 5-amino-2-chloro-N-cyclopropyl-N-methylbenzamide (CID 43264488) is 5-amino-2-chloro-N-cyclopropyl-N-methylbenzamide.
What is the SMILES notation for 5-amino-2-chloro-N-cyclopropyl-N-methylbenzamide?
The canonical SMILES for 5-amino-2-chloro-N-cyclopropyl-N-methylbenzamide is CN(C(=O)c1cc(N)ccc1Cl)C1CC1.
What is the InChIKey of 5-amino-2-chloro-N-cyclopropyl-N-methylbenzamide?
The InChIKey is UMMRMEXDBJBYLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN2O/c1-14(8-3-4-8)11(15)9-6-7(13)2-5-10(9)12/h2,5-6,8H,3-4,13H2,1H3.
What are the key properties of 5-amino-2-chloro-N-cyclopropyl-N-methylbenzamide?
5-amino-2-chloro-N-cyclopropyl-N-methylbenzamide has a molecular weight of 224.69 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-chloro-N-cyclopropyl-N-methylbenzamide is sourced from PubChem (CID 43264488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).