N-propyl-1H-pyrazole-4-carboxamide

C7H11N3O — CID 43582291

IUPACN-propyl-1H-pyrazole-4-carboxamide
SMILESCCCNC(=O)c1cn[nH]c1
InChIInChI=1S/C7H11N3O/c1-2-3-8-7(11)6-4-9-10-5-6/h4-5H,2-3H2,1H3,(H,8,11)(H,9,10)
InChIKeyNIEADRHTHWORFT-UHFFFAOYSA-N
MW153.19 g/mol
LogP0.55
Rot. Bonds3

About N-propyl-1H-pyrazole-4-carboxamide

N-propyl-1H-pyrazole-4-carboxamide (PubChem CID 43582291) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is N-propyl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-propyl-1H-pyrazole-4-carboxamide
PubChem CID43582291
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC NameN-propyl-1H-pyrazole-4-carboxamide
SMILESCCCNC(=O)c1cn[nH]c1
InChIInChI=1S/C7H11N3O/c1-2-3-8-7(11)6-4-9-10-5-6/h4-5H,2-3H2,1H3,(H,8,11)(H,9,10)
InChIKeyNIEADRHTHWORFT-UHFFFAOYSA-N
XLogP0.55
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-propyl-1H-pyrazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-dimethyl-1H-pyrazole-4-carboxamide
CID 13450481
N-((1H-pyrazol-4-yl)methyl)acetamide
CID 60756752
1H-pyrazole-4-carbohydrazide
CID 13031723
1H-Pyrazole-4-carboxamide
CID 17854756
N-ethyl-1H-pyrazole-4-carboxamide
CID 43582334
5-Amino-N-methyl-1H-pyrazole-4-carboxamide
CID 10844455
(1H-Pyrazol-4-yl)(pyrrolidin-1-yl)methanone
CID 43582286
Pyrazole-4-carbonyl azide
CID 63079793
1-(1H-pyrazole-4-carbonyl)piperidin-4-amine
CID 43565570
N-(4,4-difluorocyclohexyl)-1H-pyrazole-4-carboxamide
CID 122160170
N-(3,3-difluorocyclobutyl)-1H-pyrazole-4-carboxamide
CID 126776789
N-Methyl-1H-pyrazole-4-carboxamide
CID 43582329

Frequently Asked Questions

What is the IUPAC name of N-propyl-1H-pyrazole-4-carboxamide?
The IUPAC name of N-propyl-1H-pyrazole-4-carboxamide (CID 43582291) is N-propyl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-propyl-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-propyl-1H-pyrazole-4-carboxamide is CCCNC(=O)c1cn[nH]c1.
What is the InChIKey of N-propyl-1H-pyrazole-4-carboxamide?
The InChIKey is NIEADRHTHWORFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-2-3-8-7(11)6-4-9-10-5-6/h4-5H,2-3H2,1H3,(H,8,11)(H,9,10).
What are the key properties of N-propyl-1H-pyrazole-4-carboxamide?
N-propyl-1H-pyrazole-4-carboxamide has a molecular weight of 153.19 g/mol, XLogP of 0.55, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 43582291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).