5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile

C14H11N7 — CID 133290976

IUPAC5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile
SMILESN#Cc1cnc(NCc2ccnc(-n3cccn3)c2)cn1
InChIInChI=1S/C14H11N7/c15-7-12-9-19-13(10-17-12)18-8-11-2-4-16-14(6-11)21-5-1-3-20-21/h1-6,9-10H,8H2,(H,18,19)
InChIKeyLSAVXLADWSCOGN-UHFFFAOYSA-N
MW277.29 g/mol
LogP1.54
Rot. Bonds4

About 5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile

5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile (PubChem CID 133290976) has the molecular formula C14H11N7 and a molecular weight of 277.29 g/mol. Its IUPAC name is 5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile.

Molecular Properties

Compound Name5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile
PubChem CID133290976
Molecular FormulaC14H11N7
Molecular Weight277.29 g/mol
Exact Mass277.11
IUPAC Name5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile
SMILESN#Cc1cnc(NCc2ccnc(-n3cccn3)c2)cn1
InChIInChI=1S/C14H11N7/c15-7-12-9-19-13(10-17-12)18-8-11-2-4-16-14(6-11)21-5-1-3-20-21/h1-6,9-10H,8H2,(H,18,19)
InChIKeyLSAVXLADWSCOGN-UHFFFAOYSA-N
XLogP1.54
TPSA92.31 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.29
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-[[3-(pyrazol-1-ylmethyl)phenyl]methylamino]pyrazine-2-carbonitrile
CID 133291347
2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine
CID 62294663
5-[(3-chlorophenyl)methylamino]pyrazine-2-carbonitrile
CID 63658175
4,6-dimethyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]pyrimidin-2-amine
CID 32805633
5-[[3-(propan-2-ylamino)phenyl]methylamino]pyrazine-2-carbonitrile
CID 133490912
5-(1,3-benzodioxol-5-ylmethylamino)pyrazine-2-carbonitrile
CID 63658356
5-morpholin-4-ylsulfonyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]pyridin-2-amine
CID 55627000
4-bromo-2-methyl-5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyridazin-3-one
CID 133303303
5-phenyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1,2,4-oxadiazol-3-amine
CID 133481887
1-[3-[[(5-cyanopyrazin-2-yl)amino]methyl]phenyl]-3-phenylurea
CID 75510020
6-[(4-pyrazol-1-ylphenyl)methylamino]pyridine-3-carbonitrile
CID 47053874
4-(methylamino)-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]butanamide
CID 119846908

Frequently Asked Questions

What is the IUPAC name of 5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile?
The IUPAC name of 5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile (CID 133290976) is 5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile.
What is the SMILES notation for 5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile?
The canonical SMILES for 5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile is N#Cc1cnc(NCc2ccnc(-n3cccn3)c2)cn1.
What is the InChIKey of 5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile?
The InChIKey is LSAVXLADWSCOGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N7/c15-7-12-9-19-13(10-17-12)18-8-11-2-4-16-14(6-11)21-5-1-3-20-21/h1-6,9-10H,8H2,(H,18,19).
What are the key properties of 5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile?
5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile has a molecular weight of 277.29 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile is sourced from PubChem (CID 133290976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).