2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine

C13H18N4 — CID 62294663

IUPAC2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine
SMILESCC(C)(C)NCc1ccnc(-n2cccn2)c1
InChIInChI=1S/C13H18N4/c1-13(2,3)15-10-11-5-7-14-12(9-11)17-8-4-6-16-17/h4-9,15H,10H2,1-3H3
InChIKeyFPYLYSTXHNMTRA-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.16
Rot. Bonds3

About 2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine

2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine (PubChem CID 62294663) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine
PubChem CID62294663
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine
SMILESCC(C)(C)NCc1ccnc(-n2cccn2)c1
InChIInChI=1S/C13H18N4/c1-13(2,3)15-10-11-5-7-14-12(9-11)17-8-4-6-16-17/h4-9,15H,10H2,1-3H3
InChIKeyFPYLYSTXHNMTRA-UHFFFAOYSA-N
XLogP2.16
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4,6-dimethyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]pyrimidin-2-amine
CID 32805633
2-methyl-N-[[2-(3-methylpyrazol-1-yl)-4-pyridinyl]methyl]propan-2-amine
CID 62491577
4-propyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]cyclohexan-1-amine
CID 78871623
2-methyl-N-[(6-pyrazol-1-yl-2-pyridinyl)methyl]propan-2-amine
CID 55059602
2-(4-tert-butylphenyl)sulfanyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]acetamide
CID 55619723
tris(4-tert-butyl-2-pyrazol-1-ylpyridine);cobalt
CID 157199810
5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyrazine-2-carbonitrile
CID 133290976
4-bromo-2-methyl-5-[(2-pyrazol-1-yl-4-pyridinyl)methylamino]pyridazin-3-one
CID 133303303
4-(methylamino)-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]butanamide
CID 119846908
4-amino-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]pentanamide;dihydrochloride
CID 120564578
1-[(2-methylphenyl)methyl]-3-[(2-pyrazol-1-yl-4-pyridinyl)methyl]urea
CID 35651512
5-phenyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]-1,2,4-oxadiazol-3-amine
CID 133481887

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine (CID 62294663) is 2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine is CC(C)(C)NCc1ccnc(-n2cccn2)c1.
What is the InChIKey of 2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine?
The InChIKey is FPYLYSTXHNMTRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-13(2,3)15-10-11-5-7-14-12(9-11)17-8-4-6-16-17/h4-9,15H,10H2,1-3H3.
What are the key properties of 2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine?
2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine has a molecular weight of 230.31 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2-pyrazol-1-yl-4-pyridinyl)methyl]propan-2-amine is sourced from PubChem (CID 62294663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).