5-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carbonitrile

C14H16N6 — CID 107110581

IUPAC5-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carbonitrile
SMILESN#Cc1ccc(N2CCC(n3ccc(N)n3)CC2)cn1
InChIInChI=1S/C14H16N6/c15-9-11-1-2-13(10-17-11)19-6-3-12(4-7-19)20-8-5-14(16)18-20/h1-2,5,8,10,12H,3-4,6-7H2,(H2,16,18)
InChIKeyLMUKMFIXWYFAGQ-UHFFFAOYSA-N
MW268.32 g/mol
LogP1.57
Rot. Bonds2

About 5-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carbonitrile

5-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carbonitrile (PubChem CID 107110581) has the molecular formula C14H16N6 and a molecular weight of 268.32 g/mol. Its IUPAC name is 5-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carbonitrile.

Molecular Properties

Compound Name5-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carbonitrile
PubChem CID107110581
Molecular FormulaC14H16N6
Molecular Weight268.32 g/mol
Exact Mass268.14
IUPAC Name5-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carbonitrile
SMILESN#Cc1ccc(N2CCC(n3ccc(N)n3)CC2)cn1
InChIInChI=1S/C14H16N6/c15-9-11-1-2-13(10-17-11)19-6-3-12(4-7-19)20-8-5-14(16)18-20/h1-2,5,8,10,12H,3-4,6-7H2,(H2,16,18)
InChIKeyLMUKMFIXWYFAGQ-UHFFFAOYSA-N
XLogP1.57
TPSA83.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-[4-(2-aminoethyl)piperidin-1-yl]pyridine-2-carbonitrile
CID 115490407
5-(4-methylpiperidin-1-yl)pyridine-2-carbonitrile
CID 79839657
5-[4-(4-aminophenyl)piperazin-1-yl]pyridine-2-carbonitrile
CID 115490476
fluoromethane;5-(4-piperidin-1-ylpiperidin-1-yl)pyridine-2-carbonitrile
CID 169148651
5-[4-[(2R)-2-methylmorpholin-4-yl]piperidin-1-yl]pyridine-2-carbonitrile
CID 97119042
2-[1-(6-cyano-3-pyridinyl)piperidin-4-yl]ethyl acetate
CID 101468380
5-morpholin-4-ylpyridine-2-carbonitrile
CID 43811106
4-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carboxamide
CID 107110213
1-[1-(2-methoxy-4-pyridinyl)piperidin-4-yl]pyrazol-3-amine
CID 107110261
5-[4-(thiomorpholine-4-carbonyl)piperidin-1-yl]pyridine-2-carbonitrile
CID 163356288
1-[1-(3,5-dibromo-2-pyridinyl)piperidin-4-yl]pyrazol-3-amine
CID 107110309
5-[3-(1-aminoethyl)piperidin-1-yl]pyridine-2-carbonitrile
CID 115490405

Frequently Asked Questions

What is the IUPAC name of 5-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carbonitrile?
The IUPAC name of 5-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carbonitrile (CID 107110581) is 5-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carbonitrile.
What is the SMILES notation for 5-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carbonitrile?
The canonical SMILES for 5-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carbonitrile is N#Cc1ccc(N2CCC(n3ccc(N)n3)CC2)cn1.
What is the InChIKey of 5-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carbonitrile?
The InChIKey is LMUKMFIXWYFAGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6/c15-9-11-1-2-13(10-17-11)19-6-3-12(4-7-19)20-8-5-14(16)18-20/h1-2,5,8,10,12H,3-4,6-7H2,(H2,16,18).
What are the key properties of 5-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carbonitrile?
5-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carbonitrile has a molecular weight of 268.32 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]pyridine-2-carbonitrile is sourced from PubChem (CID 107110581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).