N-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide

C19H22N2O2 — CID 17194507

IUPACN-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide
SMILESCCN(CC)C(=O)c1cccc(NC(=O)c2cccc(C)c2)c1
InChIInChI=1S/C19H22N2O2/c1-4-21(5-2)19(23)16-10-7-11-17(13-16)20-18(22)15-9-6-8-14(3)12-15/h6-13H,4-5H2,1-3H3,(H,20,22)
InChIKeyQPABCBCJCCRFIB-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.73
Rot. Bonds5

About N-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide

N-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide (PubChem CID 17194507) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide.

Molecular Properties

Compound NameN-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide
PubChem CID17194507
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide
SMILESCCN(CC)C(=O)c1cccc(NC(=O)c2cccc(C)c2)c1
InChIInChI=1S/C19H22N2O2/c1-4-21(5-2)19(23)16-10-7-11-17(13-16)20-18(22)15-9-6-8-14(3)12-15/h6-13H,4-5H2,1-3H3,(H,20,22)
InChIKeyQPABCBCJCCRFIB-UHFFFAOYSA-N
XLogP3.73
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(diethylcarbamoyl)phenyl]-3,5-dimethylbenzamide
CID 26712665
N-[3-(diethylcarbamoyl)phenyl]-3-(prop-2-enoylamino)benzamide
CID 141125198
N-[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]-3,5-dimethylbenzamide
CID 26712597
N-[3-(diethylcarbamoyl)phenyl]-3-(trifluoromethyl)benzamide
CID 17435315
N-[4-[[2-[4-(diethylcarbamoyl)anilino]-2-oxoethyl]amino]phenyl]-3-methylbenzamide
CID 54840317
N-[4-[[2-[3-(dipropylcarbamoyl)anilino]-2-oxoethyl]amino]phenyl]-3-methylbenzamide
CID 54842373
N-[4-(diethylamino)phenyl]-3-methylbenzamide
CID 835431
3-N,3-N-diethyl-1-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109055870
N-[3-(diethylcarbamoyl)phenyl]-3-(methylsulfonylmethyl)benzamide
CID 26313396
N,N-diethyl-3-[[3-(2-methoxyethoxy)benzoyl]amino]benzamide
CID 55996557
3-[[4-(diethylaminomethyl)benzoyl]amino]-N,N-diethylbenzamide
CID 55645545
2-chloro-N-[3-(diethylcarbamoyl)phenyl]benzamide
CID 17194505

Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide?
The IUPAC name of N-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide (CID 17194507) is N-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide.
What is the SMILES notation for N-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide?
The canonical SMILES for N-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide is CCN(CC)C(=O)c1cccc(NC(=O)c2cccc(C)c2)c1.
What is the InChIKey of N-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide?
The InChIKey is QPABCBCJCCRFIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-4-21(5-2)19(23)16-10-7-11-17(13-16)20-18(22)15-9-6-8-14(3)12-15/h6-13H,4-5H2,1-3H3,(H,20,22).
What are the key properties of N-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide?
N-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide has a molecular weight of 310.40 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide is sourced from PubChem (CID 17194507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).