4-[2-(cyclopropanecarbonylamino)phenyl]-N,N-dimethylbenzamide

C19H20N2O2 — CID 56717730

IUPAC4-[2-(cyclopropanecarbonylamino)phenyl]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1ccc(-c2ccccc2NC(=O)C2CC2)cc1
InChIInChI=1S/C19H20N2O2/c1-21(2)19(23)15-11-7-13(8-12-15)16-5-3-4-6-17(16)20-18(22)14-9-10-14/h3-8,11-12,14H,9-10H2,1-2H3,(H,20,22)
InChIKeyNZXJHAMVVZYTGJ-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.40
Rot. Bonds4

About 4-[2-(cyclopropanecarbonylamino)phenyl]-N,N-dimethylbenzamide

4-[2-(cyclopropanecarbonylamino)phenyl]-N,N-dimethylbenzamide (PubChem CID 56717730) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 4-[2-(cyclopropanecarbonylamino)phenyl]-N,N-dimethylbenzamide.

Molecular Properties

Compound Name4-[2-(cyclopropanecarbonylamino)phenyl]-N,N-dimethylbenzamide
PubChem CID56717730
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name4-[2-(cyclopropanecarbonylamino)phenyl]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1ccc(-c2ccccc2NC(=O)C2CC2)cc1
InChIInChI=1S/C19H20N2O2/c1-21(2)19(23)15-11-7-13(8-12-15)16-5-3-4-6-17(16)20-18(22)14-9-10-14/h3-8,11-12,14H,9-10H2,1-2H3,(H,20,22)
InChIKeyNZXJHAMVVZYTGJ-UHFFFAOYSA-N
XLogP3.40
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(cyclopropanecarbonylamino)-N-(2-phenylphenyl)benzamide
CID 78767990
2-(cyclopentanecarbonylamino)-N,N-dimethylbenzamide
CID 39233266
1-(dimethylsulfamoyl)-N-(2-phenylphenyl)piperidine-4-carboxamide
CID 41455218
3-amino-N-(2-phenylphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119675324
N-(2-chlorophenyl)cyclopropanecarboxamide
CID 849222
(3R)-1-methyl-N-(2-phenylphenyl)pyrrolidine-3-carboxamide
CID 95338002
(3S)-1-methyl-N-(2-phenylphenyl)pyrrolidine-3-carboxamide
CID 95338001
1-N,4-N-bis(2-ethylphenyl)cyclohexane-1,4-dicarboxamide
CID 40704434
4-propan-2-yl-N-[2-[(4-propan-2-ylcyclohexanecarbonyl)amino]phenyl]cyclohexane-1-carboxamide
CID 174928613
N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide
CID 837694
N-cyclohexyl-2-(cyclopropanecarbonylamino)-N-methylbenzamide
CID 4938931
[1-[2-[[4-[(cyclopropanecarbonylamino)methyl]benzoyl]-methylamino]ethyl]piperidin-4-yl] N-(2-phenylphenyl)carbamate
CID 15984840

Frequently Asked Questions

What is the IUPAC name of 4-[2-(cyclopropanecarbonylamino)phenyl]-N,N-dimethylbenzamide?
The IUPAC name of 4-[2-(cyclopropanecarbonylamino)phenyl]-N,N-dimethylbenzamide (CID 56717730) is 4-[2-(cyclopropanecarbonylamino)phenyl]-N,N-dimethylbenzamide.
What is the SMILES notation for 4-[2-(cyclopropanecarbonylamino)phenyl]-N,N-dimethylbenzamide?
The canonical SMILES for 4-[2-(cyclopropanecarbonylamino)phenyl]-N,N-dimethylbenzamide is CN(C)C(=O)c1ccc(-c2ccccc2NC(=O)C2CC2)cc1.
What is the InChIKey of 4-[2-(cyclopropanecarbonylamino)phenyl]-N,N-dimethylbenzamide?
The InChIKey is NZXJHAMVVZYTGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-21(2)19(23)15-11-7-13(8-12-15)16-5-3-4-6-17(16)20-18(22)14-9-10-14/h3-8,11-12,14H,9-10H2,1-2H3,(H,20,22).
What are the key properties of 4-[2-(cyclopropanecarbonylamino)phenyl]-N,N-dimethylbenzamide?
4-[2-(cyclopropanecarbonylamino)phenyl]-N,N-dimethylbenzamide has a molecular weight of 308.38 g/mol, XLogP of 3.40, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(cyclopropanecarbonylamino)phenyl]-N,N-dimethylbenzamide is sourced from PubChem (CID 56717730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).