4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-carboxamide

C14H22N4O — CID 106163850

IUPAC4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-carboxamide
SMILESCCc1nn(C)c(C(=O)NCCC2=CCCC2)c1N
InChIInChI=1S/C14H22N4O/c1-3-11-12(15)13(18(2)17-11)14(19)16-9-8-10-6-4-5-7-10/h6H,3-5,7-9,15H2,1-2H3,(H,16,19)
InChIKeyOXFAJDUKFDSCED-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.79
Rot. Bonds5

About 4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-carboxamide

4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-carboxamide (PubChem CID 106163850) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-carboxamide
PubChem CID106163850
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-carboxamide
SMILESCCc1nn(C)c(C(=O)NCCC2=CCCC2)c1N
InChIInChI=1S/C14H22N4O/c1-3-11-12(15)13(18(2)17-11)14(19)16-9-8-10-6-4-5-7-10/h6H,3-5,7-9,15H2,1-2H3,(H,16,19)
InChIKeyOXFAJDUKFDSCED-UHFFFAOYSA-N
XLogP1.79
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-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

4-amino-3-ethyl-N-[2-(4-hydroxyphenyl)ethyl]-1-methylpyrazole-5-carboxamide
CID 66123377
4-amino-3-ethyl-1-methyl-N-[2-(2-methylphenyl)ethyl]pyrazole-5-carboxamide
CID 79756140
4-amino-3-ethyl-N-[2-(1H-imidazol-5-yl)ethyl]-1-methylpyrazole-5-carboxamide
CID 66119082
4-amino-N-[3-(dimethylamino)-3-oxopropyl]-3-ethyl-1-methylpyrazole-5-carboxamide
CID 66122995
4-amino-N-(3-cyclopentylpropyl)-3-ethyl-1-methylpyrazole-5-carboxamide
CID 106006327
tert-butyl N-[2-[(4-amino-3-ethyl-1-methylpyrazole-5-carbonyl)amino]ethyl]carbamate
CID 104932662
4-amino-3-ethyl-1-methyl-N-(2-prop-2-enylsulfanylethyl)pyrazole-5-carboxamide
CID 106425093
4-amino-3-ethyl-1-methyl-N-(4-propan-2-yloxybutyl)pyrazole-5-carboxamide
CID 106006154
2-amino-N-[2-(cyclopenten-1-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide
CID 106175161
4-amino-N-[2-(cyclopenten-1-yl)ethyl]-2-[ethyl(methyl)amino]-1,3-thiazole-5-carboxamide
CID 106174519
4-amino-3-ethyl-1-methyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyrazole-5-carboxamide
CID 66123952
4-amino-N-[(5-bromothiophen-2-yl)methyl]-3-ethyl-1-methylpyrazole-5-carboxamide
CID 66123758

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-carboxamide?
The IUPAC name of 4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-carboxamide (CID 106163850) is 4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-carboxamide?
The canonical SMILES for 4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-carboxamide is CCc1nn(C)c(C(=O)NCCC2=CCCC2)c1N.
What is the InChIKey of 4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-carboxamide?
The InChIKey is OXFAJDUKFDSCED-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-3-11-12(15)13(18(2)17-11)14(19)16-9-8-10-6-4-5-7-10/h6H,3-5,7-9,15H2,1-2H3,(H,16,19).
What are the key properties of 4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-carboxamide?
4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-carboxamide has a molecular weight of 262.36 g/mol, XLogP of 1.79, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(cyclopenten-1-yl)ethyl]-3-ethyl-1-methylpyrazole-5-carboxamide is sourced from PubChem (CID 106163850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).