(3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone

C11H18N4O — CID 64523249

IUPAC(3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone
SMILESCCC1CCCN(C(=O)c2cc(N)n[nH]2)C1
InChIInChI=1S/C11H18N4O/c1-2-8-4-3-5-15(7-8)11(16)9-6-10(12)14-13-9/h6,8H,2-5,7H2,1H3,(H3,12,13,14)
InChIKeyPDPPBYRNYVXALR-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.25
Rot. Bonds2

About (3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone

(3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone (PubChem CID 64523249) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is (3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone
PubChem CID64523249
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name(3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone
SMILESCCC1CCCN(C(=O)c2cc(N)n[nH]2)C1
InChIInChI=1S/C11H18N4O/c1-2-8-4-3-5-15(7-8)11(16)9-6-10(12)14-13-9/h6,8H,2-5,7H2,1H3,(H3,12,13,14)
InChIKeyPDPPBYRNYVXALR-UHFFFAOYSA-N
XLogP1.25
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone 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

US10022354, Example 209
CID 132070225
5-amino-N-methyl-1H-pyrazole-3-carboxamide
CID 51072191
3-amino-N,N-dimethyl-1H-pyrazole-5-carboxamide
CID 64523621
(3,5-dimethylpiperidin-1-yl)-(5-methyl-1H-pyrazol-3-yl)methanone
CID 6622359
(6S)-8-(3-amino-1H-pyrazole-5-carbonyl)-2-cyclopentyl-2,8-diazaspiro[5.5]undecan-3-one
CID 96384827
5-amino-N-{[trans-4-(hydroxymethyl)cyclohexyl]methyl}-1H-pyrazole-3-carboxamide
CID 124218327
3-amino-N-[2-[(3R)-oxan-3-yl]ethyl]-1H-pyrazole-5-carboxamide
CID 125444395
(1S*,5R*)-3-[(5-amino-1H-pyrazol-3-yl)carbonyl]-6-(cyclobutylmethyl)-3,6-diazabicyclo[3.2.2]nonan-7-one
CID 133119748
3-amino-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-carboxamide
CID 64523479
3-amino-N-propan-2-yl-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-carboxamide
CID 64523675
(3-amino-1H-pyrazol-5-yl)-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone
CID 64524048
3-amino-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)-1H-pyrazole-5-carboxamide
CID 64524050

Frequently Asked Questions

What is the IUPAC name of (3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone?
The IUPAC name of (3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone (CID 64523249) is (3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone.
What is the SMILES notation for (3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone?
The canonical SMILES for (3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone is CCC1CCCN(C(=O)c2cc(N)n[nH]2)C1.
What is the InChIKey of (3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone?
The InChIKey is PDPPBYRNYVXALR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-2-8-4-3-5-15(7-8)11(16)9-6-10(12)14-13-9/h6,8H,2-5,7H2,1H3,(H3,12,13,14).
What are the key properties of (3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone?
(3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone has a molecular weight of 222.29 g/mol, XLogP of 1.25, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-1H-pyrazol-5-yl)-(3-ethylpiperidin-1-yl)methanone is sourced from PubChem (CID 64523249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).