6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile

C14H15N5 — CID 95308098

IUPAC6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile
SMILESN#Cc1ccc(N2CCC[C@@H]2Cn2cccn2)nc1
InChIInChI=1S/C14H15N5/c15-9-12-4-5-14(16-10-12)19-8-1-3-13(19)11-18-7-2-6-17-18/h2,4-7,10,13H,1,3,8,11H2/t13-/m1/s1
InChIKeyRPYDUTDRCUKKNU-CYBMUJFWSA-N
MW253.31 g/mol
LogP1.82
Rot. Bonds3

About 6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile

6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile (PubChem CID 95308098) has the molecular formula C14H15N5 and a molecular weight of 253.31 g/mol. Its IUPAC name is 6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile
PubChem CID95308098
Molecular FormulaC14H15N5
Molecular Weight253.31 g/mol
Exact Mass253.13
IUPAC Name6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile
SMILESN#Cc1ccc(N2CCC[C@@H]2Cn2cccn2)nc1
InChIInChI=1S/C14H15N5/c15-9-12-4-5-14(16-10-12)19-8-1-3-13(19)11-18-7-2-6-17-18/h2,4-7,10,13H,1,3,8,11H2/t13-/m1/s1
InChIKeyRPYDUTDRCUKKNU-CYBMUJFWSA-N
XLogP1.82
TPSA57.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-[(2S)-2-(1,2,4-triazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile
CID 95305714
3-fluoro-4-[[2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]methyl]benzonitrile
CID 56780416
6-[2-[(6-oxo-3-pyridin-4-ylpyridazin-1-yl)methyl]pyrrolidin-1-yl]pyridine-3-carbonitrile
CID 126926090
6-(2-formylpiperidin-1-yl)pyridine-3-carbonitrile
CID 62662719
4-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]quinazoline
CID 95338499
(2S)-1-(5-cyano-2-pyridinyl)pyrrolidine-2-carboxylic acid
CID 30078852
4-methyl-6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyrimidin-2-amine
CID 95599907
4-[2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 56778077
1-(5-cyano-2-pyridinyl)-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide
CID 17492732
6-(3-pyrazol-1-ylpyrrolidin-1-yl)pyridine-3-carbonitrile
CID 126946418
6-[(2S)-2-[(2R)-1-acetylpyrrolidin-2-yl]pyrrolidin-1-yl]pyridine-3-carbonitrile
CID 95303369
(2S)-1-(5-cyano-2-pyridinyl)-N-cyclopropylpyrrolidine-2-carboxamide
CID 32877843

Frequently Asked Questions

What is the IUPAC name of 6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile?
The IUPAC name of 6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile (CID 95308098) is 6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile.
What is the SMILES notation for 6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile?
The canonical SMILES for 6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile is N#Cc1ccc(N2CCC[C@@H]2Cn2cccn2)nc1.
What is the InChIKey of 6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile?
The InChIKey is RPYDUTDRCUKKNU-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H15N5/c15-9-12-4-5-14(16-10-12)19-8-1-3-13(19)11-18-7-2-6-17-18/h2,4-7,10,13H,1,3,8,11H2/t13-/m1/s1.
What are the key properties of 6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile?
6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile has a molecular weight of 253.31 g/mol, XLogP of 1.82, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]pyridine-3-carbonitrile is sourced from PubChem (CID 95308098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).