6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide

C20H17FN6O — CID 164915902

IUPAC6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide
SMILESNC(=O)c1nc(C[C@H](N)c2ncccc2-n2ncc3ccccc32)ccc1F
InChIInChI=1S/C20H17FN6O/c21-14-8-7-13(26-18(14)20(23)28)10-15(22)19-17(6-3-9-24-19)27-16-5-2-1-4-12(16)11-25-27/h1-9,11,15H,10,22H2,(H2,23,28)/t15-/m0/s1
InChIKeyCLTPCDBCGIBDLI-HNNXBMFYSA-N
MW376.40 g/mol
LogP2.30
Rot. Bonds5

About 6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide

6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide (PubChem CID 164915902) has the molecular formula C20H17FN6O and a molecular weight of 376.40 g/mol. Its IUPAC name is 6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide.

Molecular Properties

Compound Name6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide
PubChem CID164915902
Molecular FormulaC20H17FN6O
Molecular Weight376.40 g/mol
Exact Mass376.14
IUPAC Name6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide
SMILESNC(=O)c1nc(C[C@H](N)c2ncccc2-n2ncc3ccccc32)ccc1F
InChIInChI=1S/C20H17FN6O/c21-14-8-7-13(26-18(14)20(23)28)10-15(22)19-17(6-3-9-24-19)27-16-5-2-1-4-12(16)11-25-27/h1-9,11,15H,10,22H2,(H2,23,28)/t15-/m0/s1
InChIKeyCLTPCDBCGIBDLI-HNNXBMFYSA-N
XLogP2.30
TPSA112.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.40
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1S)-1-(3-indazol-1-yl-2-pyridinyl)-2-(6-methyl-2-pyridinyl)ethanamine;hydrochloride
CID 171595326
6-[2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-5-methylpyridine-2-carbonitrile
CID 174161209
2-(2-indazol-1-ylphenyl)pyridine-3-carboxamide
CID 174764256
(1S)-1-[3-(5-chloroindazol-1-yl)-2-pyridinyl]-2-(3-fluoro-6-methylsulfonyl-2-pyridinyl)ethanamine
CID 171595341
(2-fluoro-6-indazol-1-ylphenyl)methanamine
CID 79517639
(1S)-1-[3-(5-fluoroindazol-1-yl)-2-pyridinyl]-2-(3-fluoro-6-isocyano-2-pyridinyl)ethanamine
CID 171595339
(1S)-2-(3-fluoro-2-pyridinyl)-1-[3-[3-(trifluoromethyl)indazol-1-yl]-2-pyridinyl]ethanamine
CID 171595344
(2-indazol-1-yl-3-pyridinyl)methanol
CID 62140582
1-(3-fluoro-4-indazol-1-ylphenyl)butan-2-amine
CID 63816242
1-(2-indazol-1-ylphenyl)ethanamine
CID 62139804
3-fluoro-6-(2-fluorophenyl)pyridine-2-carboxamide
CID 141313385
2,4-difluoro-6-indazol-1-ylaniline
CID 115507215

Frequently Asked Questions

What is the IUPAC name of 6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide?
The IUPAC name of 6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide (CID 164915902) is 6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide.
What is the SMILES notation for 6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide?
The canonical SMILES for 6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide is NC(=O)c1nc(C[C@H](N)c2ncccc2-n2ncc3ccccc32)ccc1F.
What is the InChIKey of 6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide?
The InChIKey is CLTPCDBCGIBDLI-HNNXBMFYSA-N. The full InChI is InChI=1S/C20H17FN6O/c21-14-8-7-13(26-18(14)20(23)28)10-15(22)19-17(6-3-9-24-19)27-16-5-2-1-4-12(16)11-25-27/h1-9,11,15H,10,22H2,(H2,23,28)/t15-/m0/s1.
What are the key properties of 6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide?
6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide has a molecular weight of 376.40 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2S)-2-amino-2-(3-indazol-1-yl-2-pyridinyl)ethyl]-3-fluoropyridine-2-carboxamide is sourced from PubChem (CID 164915902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).