2-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]pyridin-4-amine

C19H14F2N4 — CID 118875149

IUPAC2-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]pyridin-4-amine
SMILESNc1ccnc(-c2nn(Cc3ccc(F)cc3F)c3ccccc23)c1
InChIInChI=1S/C19H14F2N4/c20-13-6-5-12(16(21)9-13)11-25-18-4-2-1-3-15(18)19(24-25)17-10-14(22)7-8-23-17/h1-10H,11H2,(H2,22,23)
InChIKeySXOIRZWCZHMQPF-UHFFFAOYSA-N
MW336.35 g/mol
LogP4.01
Rot. Bonds3

About 2-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]pyridin-4-amine

2-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]pyridin-4-amine (PubChem CID 118875149) has the molecular formula C19H14F2N4 and a molecular weight of 336.35 g/mol. Its IUPAC name is 2-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]pyridin-4-amine.

Molecular Properties

Compound Name2-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]pyridin-4-amine
PubChem CID118875149
Molecular FormulaC19H14F2N4
Molecular Weight336.35 g/mol
Exact Mass336.12
IUPAC Name2-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]pyridin-4-amine
SMILESNc1ccnc(-c2nn(Cc3ccc(F)cc3F)c3ccccc23)c1
InChIInChI=1S/C19H14F2N4/c20-13-6-5-12(16(21)9-13)11-25-18-4-2-1-3-15(18)19(24-25)17-10-14(22)7-8-23-17/h1-10H,11H2,(H2,22,23)
InChIKeySXOIRZWCZHMQPF-UHFFFAOYSA-N
XLogP4.01
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.35
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]furan-2-yl]methanol
CID 90666918
3-(4-chlorophenyl)-1-[(2,4-difluorophenyl)methyl]cinnolin-4-one
CID 44609472
3-(2,3-difluorophenyl)-1-[(2,4-difluorophenyl)methyl]cinnolin-4-one
CID 44609933
1-[(2,4-difluorophenyl)methyl]-3-[4-(trifluoromethoxy)phenyl]cinnolin-4-one
CID 44610403
3-[3-chloro-5-(trifluoromethyl)phenyl]-1-[(2,4-difluorophenyl)methyl]cinnolin-4-one
CID 44610085
1-[(2,4-difluorophenyl)methyl]indazol-6-amine
CID 62197807
6-amino-3-[(2,4-difluorophenyl)methyl]quinazolin-4-one
CID 62197646
1-[(2,4-difluorophenyl)methyl]tetrazol-5-amine
CID 79506611
2-[1-[(4-ethoxy-2,6-difluorophenyl)methyl]indazol-3-yl]-N-(1H-pyrazol-4-yl)pyridin-4-amine
CID 86268507
3-[1-[(2,4-difluorophenyl)methyl]imidazol-2-yl]aniline
CID 62197808
5-[1-[(2-fluorophenyl)methyl]indazol-3-yl]-3-methyl-1,2,4-oxadiazole
CID 21334392
2-[1-[(2,4-difluorophenyl)methyl]imidazol-4-yl]-4-[5-(trifluoromethyl)-2H-triazol-4-yl]pyridine
CID 121454363

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]pyridin-4-amine?
The IUPAC name of 2-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]pyridin-4-amine (CID 118875149) is 2-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]pyridin-4-amine.
What is the SMILES notation for 2-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]pyridin-4-amine?
The canonical SMILES for 2-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]pyridin-4-amine is Nc1ccnc(-c2nn(Cc3ccc(F)cc3F)c3ccccc23)c1.
What is the InChIKey of 2-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]pyridin-4-amine?
The InChIKey is SXOIRZWCZHMQPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F2N4/c20-13-6-5-12(16(21)9-13)11-25-18-4-2-1-3-15(18)19(24-25)17-10-14(22)7-8-23-17/h1-10H,11H2,(H2,22,23).
What are the key properties of 2-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]pyridin-4-amine?
2-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]pyridin-4-amine has a molecular weight of 336.35 g/mol, XLogP of 4.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(2,4-difluorophenyl)methyl]indazol-3-yl]pyridin-4-amine is sourced from PubChem (CID 118875149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).