4-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzene-1,4-dicarboxamide

C14H14N4O2 — CID 5330977

IUPAC4-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzene-1,4-dicarboxamide
SMILESNC(=O)c1ccc(C(=O)Nc2cc(C3CC3)[nH]n2)cc1
InChIInChI=1S/C14H14N4O2/c15-13(19)9-3-5-10(6-4-9)14(20)16-12-7-11(17-18-12)8-1-2-8/h3-8H,1-2H2,(H2,15,19)(H2,16,17,18,20)
InChIKeyHGEJNHUGVPFHIF-UHFFFAOYSA-N
MW270.29 g/mol
LogP1.64
Rot. Bonds4

About 4-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzene-1,4-dicarboxamide

4-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzene-1,4-dicarboxamide (PubChem CID 5330977) has the molecular formula C14H14N4O2 and a molecular weight of 270.29 g/mol. Its IUPAC name is 4-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzene-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzene-1,4-dicarboxamide
PubChem CID5330977
Molecular FormulaC14H14N4O2
Molecular Weight270.29 g/mol
Exact Mass270.11
IUPAC Name4-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzene-1,4-dicarboxamide
SMILESNC(=O)c1ccc(C(=O)Nc2cc(C3CC3)[nH]n2)cc1
InChIInChI=1S/C14H14N4O2/c15-13(19)9-3-5-10(6-4-9)14(20)16-12-7-11(17-18-12)8-1-2-8/h3-8H,1-2H2,(H2,15,19)(H2,16,17,18,20)
InChIKeyHGEJNHUGVPFHIF-UHFFFAOYSA-N
XLogP1.64
TPSA100.87 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 51.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

Pnu-292137
CID 449087
N-(5-Cyclopropyl-1h-Pyrazol-3-Yl)Benzamide
CID 449088
N1-(3-phenyl-1H-pyrazol-5-yl)-4-chlorobenzamide
CID 339736
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-fluoro-2-phenylacetamide
CID 5330942
(2S)-2-amino-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-phenylacetamide
CID 5330943
Pha-533533
CID 5330949
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-[4-(2-oxopiperidin-1-yl)phenyl]propanamide
CID 5330950
3-Aminopyrazole deriv. 28
CID 5330962
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(4-pyrrolidin-1-ylphenyl)propanamide
CID 5330969
4-bromo-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzamide
CID 5330973
4-chloro-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzamide
CID 5330974
4-[(5-cyclopropyl-1H-pyrazol-3-yl)carbamoyl]benzoic acid
CID 5330976

Frequently Asked Questions

What is the IUPAC name of 4-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzene-1,4-dicarboxamide?
The IUPAC name of 4-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzene-1,4-dicarboxamide (CID 5330977) is 4-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzene-1,4-dicarboxamide.
What is the SMILES notation for 4-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzene-1,4-dicarboxamide?
The canonical SMILES for 4-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzene-1,4-dicarboxamide is NC(=O)c1ccc(C(=O)Nc2cc(C3CC3)[nH]n2)cc1.
What is the InChIKey of 4-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzene-1,4-dicarboxamide?
The InChIKey is HGEJNHUGVPFHIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O2/c15-13(19)9-3-5-10(6-4-9)14(20)16-12-7-11(17-18-12)8-1-2-8/h3-8H,1-2H2,(H2,15,19)(H2,16,17,18,20).
What are the key properties of 4-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzene-1,4-dicarboxamide?
4-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzene-1,4-dicarboxamide has a molecular weight of 270.29 g/mol, XLogP of 1.64, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(5-cyclopropyl-1H-pyrazol-3-yl)benzene-1,4-dicarboxamide is sourced from PubChem (CID 5330977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).