(2R)-N-[2-(1H-pyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide

C10H16N4O — CID 122625537

IUPAC(2R)-N-[2-(1H-pyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide
SMILESO=C(NCCc1cn[nH]c1)[C@H]1CCCN1
InChIInChI=1S/C10H16N4O/c15-10(9-2-1-4-11-9)12-5-3-8-6-13-14-7-8/h6-7,9,11H,1-5H2,(H,12,15)(H,13,14)/t9-/m1/s1
InChIKeyMDHVAHAPGQCZNY-SECBINFHSA-N
MW208.26 g/mol
LogP-0.18
Rot. Bonds4

About (2R)-N-[2-(1H-pyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide

(2R)-N-[2-(1H-pyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide (PubChem CID 122625537) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is (2R)-N-[2-(1H-pyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[2-(1H-pyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide
PubChem CID122625537
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name(2R)-N-[2-(1H-pyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide
SMILESO=C(NCCc1cn[nH]c1)[C@H]1CCCN1
InChIInChI=1S/C10H16N4O/c15-10(9-2-1-4-11-9)12-5-3-8-6-13-14-7-8/h6-7,9,11H,1-5H2,(H,12,15)(H,13,14)/t9-/m1/s1
InChIKeyMDHVAHAPGQCZNY-SECBINFHSA-N
XLogP-0.18
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 5-0.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(3R*,4S*)-4-cyclopropyl-1-[4-(1H-pyrazol-4-yl)butanoyl]pyrrolidin-3-amine
CID 72849771
1-[(3R,4S)-3-amino-4-propylpyrrolidin-1-yl]-4-(1H-pyrazol-4-yl)butan-1-one
CID 72851912
(1S*,6R*)-9-[4-(1H-pyrazol-4-yl)butanoyl]-3,9-diazabicyclo[4.2.1]nonane
CID 74243011
4-(1H-Pyrazol-4-YL)-N-{2-[(2S)-pyrrolidin-2-YL]ethyl}butanamide
CID 74247815
1-(cyclohexylcarbonyl)-N-[2-(1H-pyrazol-4-yl)ethyl]-L-prolinamide
CID 86286284
(2R)-2-Amino-2-cyclohexyl-N-[2-(1H-pyrazol-4-YL)ethyl]acetamide
CID 90653977
2-methyl-N-[2-(1H-pyrazol-4-yl)ethyl]-2-pyrrolidin-1-ylpropanamide
CID 119069590
N-[2-Methyl-2-(4-methylpiperazin-1-YL)propyl]-3-(1H-pyrazol-4-YL)propanamide
CID 124206842
6-(1H-Pyrazol-4-yl)piperazin-2-one
CID 139343789
4,4-difluoro-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide
CID 120348344
(4,4-difluoropyrrolidin-2-yl)-[4-(1H-pyrazol-4-yl)piperidin-1-yl]methanone;dihydrochloride
CID 120351761
(4,4-difluoropyrrolidin-2-yl)-[4-(1H-pyrazol-4-yl)piperidin-1-yl]methanone
CID 120351762

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-(1H-pyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-[2-(1H-pyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide (CID 122625537) is (2R)-N-[2-(1H-pyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-[2-(1H-pyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-[2-(1H-pyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide is O=C(NCCc1cn[nH]c1)[C@H]1CCCN1.
What is the InChIKey of (2R)-N-[2-(1H-pyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide?
The InChIKey is MDHVAHAPGQCZNY-SECBINFHSA-N. The full InChI is InChI=1S/C10H16N4O/c15-10(9-2-1-4-11-9)12-5-3-8-6-13-14-7-8/h6-7,9,11H,1-5H2,(H,12,15)(H,13,14)/t9-/m1/s1.
What are the key properties of (2R)-N-[2-(1H-pyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide?
(2R)-N-[2-(1H-pyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide has a molecular weight of 208.26 g/mol, XLogP of -0.18, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-(1H-pyrazol-4-yl)ethyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 122625537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).