3,5-difluoro-N-[2-(6-methyl-1H-indazol-4-yl)ethyl]pyridin-4-amine

C15H14F2N4 — CID 167804192

IUPAC3,5-difluoro-N-[2-(6-methyl-1H-indazol-4-yl)ethyl]pyridin-4-amine
SMILESCc1cc(CCNc2c(F)cncc2F)c2cn[nH]c2c1
InChIInChI=1S/C15H14F2N4/c1-9-4-10(11-6-20-21-14(11)5-9)2-3-19-15-12(16)7-18-8-13(15)17/h4-8H,2-3H2,1H3,(H,18,19)(H,20,21)
InChIKeyOJEFHUZHWWTVFF-UHFFFAOYSA-N
MW288.30 g/mol
LogP3.20
Rot. Bonds4

About 3,5-difluoro-N-[2-(6-methyl-1H-indazol-4-yl)ethyl]pyridin-4-amine

3,5-difluoro-N-[2-(6-methyl-1H-indazol-4-yl)ethyl]pyridin-4-amine (PubChem CID 167804192) has the molecular formula C15H14F2N4 and a molecular weight of 288.30 g/mol. Its IUPAC name is 3,5-difluoro-N-[2-(6-methyl-1H-indazol-4-yl)ethyl]pyridin-4-amine.

Molecular Properties

Compound Name3,5-difluoro-N-[2-(6-methyl-1H-indazol-4-yl)ethyl]pyridin-4-amine
PubChem CID167804192
Molecular FormulaC15H14F2N4
Molecular Weight288.30 g/mol
Exact Mass288.12
IUPAC Name3,5-difluoro-N-[2-(6-methyl-1H-indazol-4-yl)ethyl]pyridin-4-amine
SMILESCc1cc(CCNc2c(F)cncc2F)c2cn[nH]c2c1
InChIInChI=1S/C15H14F2N4/c1-9-4-10(11-6-20-21-14(11)5-9)2-3-19-15-12(16)7-18-8-13(15)17/h4-8H,2-3H2,1H3,(H,18,19)(H,20,21)
InChIKeyOJEFHUZHWWTVFF-UHFFFAOYSA-N
XLogP3.20
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.30
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoro-6-methyl-1H-indazole
CID 24728805
4-[[(6-methyl-1H-indazol-4-yl)amino]methyl]phenol
CID 130335525
N-[2-(4-chlorophenyl)ethyl]-3,5-difluoropyridin-4-amine
CID 167960431
3,5-difluoro-N-[2-(3-pyridin-4-yl-1H-pyrazol-5-yl)ethyl]pyridin-4-amine
CID 167816200
6-methyl-1H-indazole-4-carbohydrazide
CID 91582443
6-bromo-4-propyl-1H-indazole
CID 118396502
5-chloro-6-fluoro-4-(2-methylbutan-2-yl)-1H-indazole
CID 170282210
4-fluoro-1H-indazol-6-ol
CID 135742426
5-chloro-4-ethyl-6-fluoro-1H-indazole
CID 139364624
5-fluoro-4-methyl-1H-indazol-6-ol
CID 163233375
4-bromo-6-fluoro-5-methyl-1H-indazole
CID 139508183
3,5-difluoro-N-(2-isoquinolin-6-ylethyl)pyridin-4-amine
CID 167779053

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-N-[2-(6-methyl-1H-indazol-4-yl)ethyl]pyridin-4-amine?
The IUPAC name of 3,5-difluoro-N-[2-(6-methyl-1H-indazol-4-yl)ethyl]pyridin-4-amine (CID 167804192) is 3,5-difluoro-N-[2-(6-methyl-1H-indazol-4-yl)ethyl]pyridin-4-amine.
What is the SMILES notation for 3,5-difluoro-N-[2-(6-methyl-1H-indazol-4-yl)ethyl]pyridin-4-amine?
The canonical SMILES for 3,5-difluoro-N-[2-(6-methyl-1H-indazol-4-yl)ethyl]pyridin-4-amine is Cc1cc(CCNc2c(F)cncc2F)c2cn[nH]c2c1.
What is the InChIKey of 3,5-difluoro-N-[2-(6-methyl-1H-indazol-4-yl)ethyl]pyridin-4-amine?
The InChIKey is OJEFHUZHWWTVFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N4/c1-9-4-10(11-6-20-21-14(11)5-9)2-3-19-15-12(16)7-18-8-13(15)17/h4-8H,2-3H2,1H3,(H,18,19)(H,20,21).
What are the key properties of 3,5-difluoro-N-[2-(6-methyl-1H-indazol-4-yl)ethyl]pyridin-4-amine?
3,5-difluoro-N-[2-(6-methyl-1H-indazol-4-yl)ethyl]pyridin-4-amine has a molecular weight of 288.30 g/mol, XLogP of 3.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-N-[2-(6-methyl-1H-indazol-4-yl)ethyl]pyridin-4-amine is sourced from PubChem (CID 167804192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).