(2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride

C10H17ClN4O — CID 119292192

IUPAC(2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride
SMILESCCn1cc(NC(=O)[C@@H]2CCCN2)cn1.Cl
InChIInChI=1S/C10H16N4O.ClH/c1-2-14-7-8(6-12-14)13-10(15)9-4-3-5-11-9;/h6-7,9,11H,2-5H2,1H3,(H,13,15);1H/t9-;/m0./s1
InChIKeyOXISLCAJWDJNBN-FVGYRXGTSA-N
MW244.73 g/mol
LogP1.02
Rot. Bonds3

About (2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride

(2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride (PubChem CID 119292192) has the molecular formula C10H17ClN4O and a molecular weight of 244.73 g/mol. Its IUPAC name is (2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride
PubChem CID119292192
Molecular FormulaC10H17ClN4O
Molecular Weight244.73 g/mol
Exact Mass244.11
IUPAC Name(2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride
SMILESCCn1cc(NC(=O)[C@@H]2CCCN2)cn1.Cl
InChIInChI=1S/C10H16N4O.ClH/c1-2-14-7-8(6-12-14)13-10(15)9-4-3-5-11-9;/h6-7,9,11H,2-5H2,1H3,(H,13,15);1H/t9-;/m0./s1
InChIKeyOXISLCAJWDJNBN-FVGYRXGTSA-N
XLogP1.02
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.73
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]pyrrolidine-2-carboxamide
CID 61163094
(2S)-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyrrolidine-2-carboxamide
CID 61179722
N-[1-[2-(cyclopentylamino)-2-oxoethyl]pyrazol-4-yl]pyrrolidine-2-carboxamide
CID 119309124
(2S)-N-[1-[2-(diethylamino)ethyl]pyrazol-4-yl]piperidine-2-carboxamide
CID 103813844
(2S)-N-(1-benzylpyrazol-4-yl)piperidine-2-carboxamide;hydrochloride
CID 119740026
(2S)-N-(1-propan-2-ylpyrazol-4-yl)pyrrolidine-2-carboxamide
CID 62902493
N-(1-pyrimidin-2-ylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride
CID 119328811
N-(1-ethylpyrazol-4-yl)-4-methoxypyrrolidine-2-carboxamide
CID 61213731
N-(1-ethylpyrazol-4-yl)-2,3-dihydro-1H-indole-2-carboxamide
CID 76893175
2-[4-[(4-methylpiperidine-2-carbonyl)amino]pyrazol-1-yl]acetic acid
CID 115867060
(2S)-N-(3,5-dimethylphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 67505940
(2S)-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119304111

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of (2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride (CID 119292192) is (2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for (2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for (2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride is CCn1cc(NC(=O)[C@@H]2CCCN2)cn1.Cl.
What is the InChIKey of (2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is OXISLCAJWDJNBN-FVGYRXGTSA-N. The full InChI is InChI=1S/C10H16N4O.ClH/c1-2-14-7-8(6-12-14)13-10(15)9-4-3-5-11-9;/h6-7,9,11H,2-5H2,1H3,(H,13,15);1H/t9-;/m0./s1.
What are the key properties of (2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride?
(2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 244.73 g/mol, XLogP of 1.02, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(1-ethylpyrazol-4-yl)pyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119292192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).