1-ethyl-N-(3-methoxypropyl)pyrazole-4-carboxamide

C10H17N3O2 — CID 19281191

IUPAC1-ethyl-N-(3-methoxypropyl)pyrazole-4-carboxamide
SMILESCCn1cc(C(=O)NCCCOC)cn1
InChIInChI=1S/C10H17N3O2/c1-3-13-8-9(7-12-13)10(14)11-5-4-6-15-2/h7-8H,3-6H2,1-2H3,(H,11,14)
InChIKeyXMCUYEAZNOQMOG-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.67
Rot. Bonds6

About 1-ethyl-N-(3-methoxypropyl)pyrazole-4-carboxamide

1-ethyl-N-(3-methoxypropyl)pyrazole-4-carboxamide (PubChem CID 19281191) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 1-ethyl-N-(3-methoxypropyl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-(3-methoxypropyl)pyrazole-4-carboxamide
PubChem CID19281191
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name1-ethyl-N-(3-methoxypropyl)pyrazole-4-carboxamide
SMILESCCn1cc(C(=O)NCCCOC)cn1
InChIInChI=1S/C10H17N3O2/c1-3-13-8-9(7-12-13)10(14)11-5-4-6-15-2/h7-8H,3-6H2,1-2H3,(H,11,14)
InChIKeyXMCUYEAZNOQMOG-UHFFFAOYSA-N
XLogP0.67
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-ethyl-N-(3-methoxypropyl)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

1-Methyl-1H-pyrazole-4-carboxamide
CID 14579135
1-(2-hydroxyethyl)-1H-pyrazole-4-carboxamide
CID 122164183
N,1-diethyl-N-[3-(4-morpholinyl)propyl]-1H-pyrazole-4-carboxamide trifluoroacetate
CID 28392279
N-[(1-ethylpyrazol-4-yl)methyl]-3-methylbutanamide
CID 35276265
(1-Ethylpyrazol-4-yl)-morpholin-4-ylmethanone
CID 35762493
N-[(1-ethylpyrazol-4-yl)methyl]-2-methylpropanamide
CID 39891826
N-(3-methoxypropyl)-4-[[(1-methylpyrazole-4-carbonyl)amino]methyl]piperidine-1-carboxamide
CID 53544420
methyl 3-(4-carbamoyl-1H-pyrazol-1-yl)propanoate
CID 50896619
1-methyl-N-(piperidin-4-ylmethyl)-1H-pyrazole-4-carboxamide
CID 28742812
(2S)-2-methyl-1-(1-methyl-1H-pyrazole-4-carbonyl)piperazine dihydrochloride
CID 170913622
5-(1-Ethylpyrazole-4-carbonyl)-1,5-diazacycloundecan-2-one
CID 110201427
5-[3-(4-methyl-1H-pyrazol-1-yl)propanoyl]-1,5-diazacycloundecan-2-one
CID 110201428

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(3-methoxypropyl)pyrazole-4-carboxamide?
The IUPAC name of 1-ethyl-N-(3-methoxypropyl)pyrazole-4-carboxamide (CID 19281191) is 1-ethyl-N-(3-methoxypropyl)pyrazole-4-carboxamide.
What is the SMILES notation for 1-ethyl-N-(3-methoxypropyl)pyrazole-4-carboxamide?
The canonical SMILES for 1-ethyl-N-(3-methoxypropyl)pyrazole-4-carboxamide is CCn1cc(C(=O)NCCCOC)cn1.
What is the InChIKey of 1-ethyl-N-(3-methoxypropyl)pyrazole-4-carboxamide?
The InChIKey is XMCUYEAZNOQMOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-3-13-8-9(7-12-13)10(14)11-5-4-6-15-2/h7-8H,3-6H2,1-2H3,(H,11,14).
What are the key properties of 1-ethyl-N-(3-methoxypropyl)pyrazole-4-carboxamide?
1-ethyl-N-(3-methoxypropyl)pyrazole-4-carboxamide has a molecular weight of 211.26 g/mol, XLogP of 0.67, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(3-methoxypropyl)pyrazole-4-carboxamide is sourced from PubChem (CID 19281191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).