3-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-4-carboxamide

C15H16FN3O — CID 105069963

IUPAC3-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-4-carboxamide
SMILESCC(Cc1ccc(F)cc1)NC(=O)c1ccncc1N
InChIInChI=1S/C15H16FN3O/c1-10(8-11-2-4-12(16)5-3-11)19-15(20)13-6-7-18-9-14(13)17/h2-7,9-10H,8,17H2,1H3,(H,19,20)
InChIKeyNITGODGRJLSDKZ-UHFFFAOYSA-N
MW273.31 g/mol
LogP2.16
Rot. Bonds4

About 3-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-4-carboxamide

3-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-4-carboxamide (PubChem CID 105069963) has the molecular formula C15H16FN3O and a molecular weight of 273.31 g/mol. Its IUPAC name is 3-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-4-carboxamide.

Molecular Properties

Compound Name3-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-4-carboxamide
PubChem CID105069963
Molecular FormulaC15H16FN3O
Molecular Weight273.31 g/mol
Exact Mass273.13
IUPAC Name3-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-4-carboxamide
SMILESCC(Cc1ccc(F)cc1)NC(=O)c1ccncc1N
InChIInChI=1S/C15H16FN3O/c1-10(8-11-2-4-12(16)5-3-11)19-15(20)13-6-7-18-9-14(13)17/h2-7,9-10H,8,17H2,1H3,(H,19,20)
InChIKeyNITGODGRJLSDKZ-UHFFFAOYSA-N
XLogP2.16
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-3-carboxamide
CID 63008606
3-amino-N-(1-methylsulfanylpropan-2-yl)pyridine-4-carboxamide
CID 105071212
3-amino-N-hexan-2-ylpyridine-4-carboxamide
CID 105069738
6-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-3-carboxamide
CID 63009864
3-amino-N-[1-(methylamino)-1-oxopropan-2-yl]pyridine-4-carboxamide
CID 105069443
3-amino-N-[1-(2-methoxyethylamino)-1-oxopropan-2-yl]pyridine-4-carboxamide
CID 105071103
3-amino-N-(2-methylpropyl)pyridine-4-carboxamide
CID 110848376
(2R)-2-amino-N-[1-(4-fluorophenyl)propan-2-yl]propanamide
CID 78919872
5-bromo-2-fluoro-N-[1-(4-fluorophenyl)propan-2-yl]benzamide
CID 60795149
3-bromo-2-fluoro-N-[1-(4-fluorophenyl)propan-2-yl]benzamide
CID 106544298
ethane;N-[1-(4-fluorophenyl)propan-2-yl]acetamide
CID 166127802
2-amino-4-bromo-N-[1-(4-bromophenyl)propan-2-yl]benzamide
CID 79705015

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-4-carboxamide?
The IUPAC name of 3-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-4-carboxamide (CID 105069963) is 3-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-4-carboxamide.
What is the SMILES notation for 3-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-4-carboxamide?
The canonical SMILES for 3-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-4-carboxamide is CC(Cc1ccc(F)cc1)NC(=O)c1ccncc1N.
What is the InChIKey of 3-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-4-carboxamide?
The InChIKey is NITGODGRJLSDKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN3O/c1-10(8-11-2-4-12(16)5-3-11)19-15(20)13-6-7-18-9-14(13)17/h2-7,9-10H,8,17H2,1H3,(H,19,20).
What are the key properties of 3-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-4-carboxamide?
3-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-4-carboxamide has a molecular weight of 273.31 g/mol, XLogP of 2.16, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[1-(4-fluorophenyl)propan-2-yl]pyridine-4-carboxamide is sourced from PubChem (CID 105069963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).