N-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1H-indazol-5-amine

C17H16N6 — CID 75386369

IUPACN-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1H-indazol-5-amine
SMILESCn1cc(CNc2ccc3[nH]ncc3c2)c(-c2ccncc2)n1
InChIInChI=1S/C17H16N6/c1-23-11-14(17(22-23)12-4-6-18-7-5-12)9-19-15-2-3-16-13(8-15)10-20-21-16/h2-8,10-11,19H,9H2,1H3,(H,20,21)
InChIKeyKRDAZFBNJHNYJA-UHFFFAOYSA-N
MW304.36 g/mol
LogP2.97
Rot. Bonds4

About N-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1H-indazol-5-amine

N-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1H-indazol-5-amine (PubChem CID 75386369) has the molecular formula C17H16N6 and a molecular weight of 304.36 g/mol. Its IUPAC name is N-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1H-indazol-5-amine.

Molecular Properties

Compound NameN-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1H-indazol-5-amine
PubChem CID75386369
Molecular FormulaC17H16N6
Molecular Weight304.36 g/mol
Exact Mass304.14
IUPAC NameN-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1H-indazol-5-amine
SMILESCn1cc(CNc2ccc3[nH]ncc3c2)c(-c2ccncc2)n1
InChIInChI=1S/C17H16N6/c1-23-11-14(17(22-23)12-4-6-18-7-5-12)9-19-15-2-3-16-13(8-15)10-20-21-16/h2-8,10-11,19H,9H2,1H3,(H,20,21)
InChIKeyKRDAZFBNJHNYJA-UHFFFAOYSA-N
XLogP2.97
TPSA71.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.36
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(3-tert-butyl-1-methylpyrazol-4-yl)methyl]-1H-indazol-6-amine
CID 83090155
N-[(4-chloro-2-methylphenyl)methyl]-1H-indazol-5-amine
CID 104854338
N-[(2,4,5-trimethylphenyl)methyl]-1H-indazol-5-amine
CID 43782695
N-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-4-(pyrazol-1-ylmethyl)aniline
CID 71913521
4-[(1H-indazol-5-ylamino)methyl]-1,5-dimethylpyrrole-2-carbonitrile
CID 75389926
trans-(1R,2R)-2-[4-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methylamino]phenyl]cyclopropane-1-carboxylic acid
CID 166253534
N-[(1-ethylpyrrol-3-yl)methyl]-1H-indazol-5-amine
CID 66414928
N-[(4-ethylphenyl)methyl]-1H-indazol-5-amine
CID 43690856
N-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]propan-1-amine
CID 78971667
N-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine
CID 66164096
N-[(4-tert-butylphenyl)methyl]-1H-indazol-5-amine
CID 43231004
N-(1-benzothiophen-3-ylmethyl)-1H-indazol-5-amine
CID 62699427

Frequently Asked Questions

What is the IUPAC name of N-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1H-indazol-5-amine?
The IUPAC name of N-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1H-indazol-5-amine (CID 75386369) is N-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1H-indazol-5-amine.
What is the SMILES notation for N-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1H-indazol-5-amine?
The canonical SMILES for N-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1H-indazol-5-amine is Cn1cc(CNc2ccc3[nH]ncc3c2)c(-c2ccncc2)n1.
What is the InChIKey of N-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1H-indazol-5-amine?
The InChIKey is KRDAZFBNJHNYJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N6/c1-23-11-14(17(22-23)12-4-6-18-7-5-12)9-19-15-2-3-16-13(8-15)10-20-21-16/h2-8,10-11,19H,9H2,1H3,(H,20,21).
What are the key properties of N-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1H-indazol-5-amine?
N-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1H-indazol-5-amine has a molecular weight of 304.36 g/mol, XLogP of 2.97, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1H-indazol-5-amine is sourced from PubChem (CID 75386369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).