4-fluoro-2-methoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline

C15H14FN3O — CID 63315130

IUPAC4-fluoro-2-methoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline
SMILESCOc1cc(F)ccc1NCc1cnn2ccccc12
InChIInChI=1S/C15H14FN3O/c1-20-15-8-12(16)5-6-13(15)17-9-11-10-18-19-7-3-2-4-14(11)19/h2-8,10,17H,9H2,1H3
InChIKeyBCBGEFMBEKSGKA-UHFFFAOYSA-N
MW271.30 g/mol
LogP3.09
Rot. Bonds4

About 4-fluoro-2-methoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline

4-fluoro-2-methoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline (PubChem CID 63315130) has the molecular formula C15H14FN3O and a molecular weight of 271.30 g/mol. Its IUPAC name is 4-fluoro-2-methoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline.

Molecular Properties

Compound Name4-fluoro-2-methoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline
PubChem CID63315130
Molecular FormulaC15H14FN3O
Molecular Weight271.30 g/mol
Exact Mass271.11
IUPAC Name4-fluoro-2-methoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline
SMILESCOc1cc(F)ccc1NCc1cnn2ccccc12
InChIInChI=1S/C15H14FN3O/c1-20-15-8-12(16)5-6-13(15)17-9-11-10-18-19-7-3-2-4-14(11)19/h2-8,10,17H,9H2,1H3
InChIKeyBCBGEFMBEKSGKA-UHFFFAOYSA-N
XLogP3.09
TPSA38.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.30
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-4-methyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline
CID 63315302
2-fluoro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline
CID 63311958
2-[(4-fluoro-2-methoxyanilino)methyl]phenol
CID 54968351
2-(methoxymethyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline
CID 63312144
4-bromo-2-methoxy-6-methyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline
CID 63315167
2-ethyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline
CID 63312135
4-fluoro-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)benzoic acid
CID 63312195
4-fluoro-2-methoxy-N-[[2-(trifluoromethyl)phenyl]methyl]aniline
CID 55591594
4-fluoro-2-methoxy-N-(2-pyrazol-1-ylethyl)aniline
CID 54968374
3-fluoro-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)benzamide
CID 90538443
2-[2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)phenyl]acetamide
CID 63315386
3-methoxy-4-(pyrazolo[1,5-a]pyrimidin-3-ylmethylamino)benzamide
CID 130350382

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-methoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline?
The IUPAC name of 4-fluoro-2-methoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline (CID 63315130) is 4-fluoro-2-methoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline.
What is the SMILES notation for 4-fluoro-2-methoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline?
The canonical SMILES for 4-fluoro-2-methoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline is COc1cc(F)ccc1NCc1cnn2ccccc12.
What is the InChIKey of 4-fluoro-2-methoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline?
The InChIKey is BCBGEFMBEKSGKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O/c1-20-15-8-12(16)5-6-13(15)17-9-11-10-18-19-7-3-2-4-14(11)19/h2-8,10,17H,9H2,1H3.
What are the key properties of 4-fluoro-2-methoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline?
4-fluoro-2-methoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline has a molecular weight of 271.30 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-methoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline is sourced from PubChem (CID 63315130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).