4-[(dimethylamino)methyl]-N-(4-ethyl-1H-pyrazol-5-yl)benzamide

C15H20N4O — CID 115692357

IUPAC4-[(dimethylamino)methyl]-N-(4-ethyl-1H-pyrazol-5-yl)benzamide
SMILESCCc1cn[nH]c1NC(=O)c1ccc(CN(C)C)cc1
InChIInChI=1S/C15H20N4O/c1-4-12-9-16-18-14(12)17-15(20)13-7-5-11(6-8-13)10-19(2)3/h5-9H,4,10H2,1-3H3,(H2,16,17,18,20)
InChIKeyZHHHQQHEGCJVCC-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.29
Rot. Bonds5

About 4-[(dimethylamino)methyl]-N-(4-ethyl-1H-pyrazol-5-yl)benzamide

4-[(dimethylamino)methyl]-N-(4-ethyl-1H-pyrazol-5-yl)benzamide (PubChem CID 115692357) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 4-[(dimethylamino)methyl]-N-(4-ethyl-1H-pyrazol-5-yl)benzamide.

Molecular Properties

Compound Name4-[(dimethylamino)methyl]-N-(4-ethyl-1H-pyrazol-5-yl)benzamide
PubChem CID115692357
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name4-[(dimethylamino)methyl]-N-(4-ethyl-1H-pyrazol-5-yl)benzamide
SMILESCCc1cn[nH]c1NC(=O)c1ccc(CN(C)C)cc1
InChIInChI=1S/C15H20N4O/c1-4-12-9-16-18-14(12)17-15(20)13-7-5-11(6-8-13)10-19(2)3/h5-9H,4,10H2,1-3H3,(H2,16,17,18,20)
InChIKeyZHHHQQHEGCJVCC-UHFFFAOYSA-N
XLogP2.29
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(dimethylamino)methyl]-N-(1H-pyrazol-5-yl)benzamide
CID 61393919
N-(4-ethyl-1H-pyrazol-5-yl)-3,4-difluorobenzamide
CID 113251945
N-(4-ethyl-1H-pyrazol-5-yl)pyrimidine-5-carboxamide
CID 104629328
N-(4-ethyl-1H-pyrazol-5-yl)-2H-benzotriazole-5-carboxamide
CID 115692336
4-bromo-3-chloro-N-(4-ethyl-1H-pyrazol-5-yl)benzamide
CID 112699962
N-(4-ethyl-1H-pyrazol-5-yl)-3-methoxy-4-methylbenzamide
CID 115680812
2-bromo-N-(4-ethyl-1H-pyrazol-5-yl)pyridine-4-carboxamide
CID 113258806
4-[(dimethylamino)methyl]-N-(3-ethyl-4-methyl-1,2-oxazol-5-yl)benzamide
CID 134702961
N-[4-[(dimethylamino)methyl]phenyl]-4-methylbenzamide
CID 37243297
N-(4-ethyl-1H-pyrazol-5-yl)-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 104619305
3-bromo-5-chloro-N-(4-ethyl-1H-pyrazol-5-yl)benzamide
CID 113286320
N-[4-[(dimethylamino)methyl]phenyl]-4-iodobenzamide
CID 31416592

Frequently Asked Questions

What is the IUPAC name of 4-[(dimethylamino)methyl]-N-(4-ethyl-1H-pyrazol-5-yl)benzamide?
The IUPAC name of 4-[(dimethylamino)methyl]-N-(4-ethyl-1H-pyrazol-5-yl)benzamide (CID 115692357) is 4-[(dimethylamino)methyl]-N-(4-ethyl-1H-pyrazol-5-yl)benzamide.
What is the SMILES notation for 4-[(dimethylamino)methyl]-N-(4-ethyl-1H-pyrazol-5-yl)benzamide?
The canonical SMILES for 4-[(dimethylamino)methyl]-N-(4-ethyl-1H-pyrazol-5-yl)benzamide is CCc1cn[nH]c1NC(=O)c1ccc(CN(C)C)cc1.
What is the InChIKey of 4-[(dimethylamino)methyl]-N-(4-ethyl-1H-pyrazol-5-yl)benzamide?
The InChIKey is ZHHHQQHEGCJVCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-4-12-9-16-18-14(12)17-15(20)13-7-5-11(6-8-13)10-19(2)3/h5-9H,4,10H2,1-3H3,(H2,16,17,18,20).
What are the key properties of 4-[(dimethylamino)methyl]-N-(4-ethyl-1H-pyrazol-5-yl)benzamide?
4-[(dimethylamino)methyl]-N-(4-ethyl-1H-pyrazol-5-yl)benzamide has a molecular weight of 272.35 g/mol, XLogP of 2.29, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(dimethylamino)methyl]-N-(4-ethyl-1H-pyrazol-5-yl)benzamide is sourced from PubChem (CID 115692357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).