N-(6-amino-3-pyridinyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide;hydrochloride

C16H17ClF3N3O — CID 119515907

IUPACN-(6-amino-3-pyridinyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide;hydrochloride
SMILESCC(C)(C(=O)Nc1ccc(N)nc1)c1cccc(C(F)(F)F)c1.Cl
InChIInChI=1S/C16H16F3N3O.ClH/c1-15(2,10-4-3-5-11(8-10)16(17,18)19)14(23)22-12-6-7-13(20)21-9-12;/h3-9H,1-2H3,(H2,20,21)(H,22,23);1H
InChIKeySKVBILADGFCGBA-UHFFFAOYSA-N
MW359.78 g/mol
LogP4.02
Rot. Bonds3

About N-(6-amino-3-pyridinyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide;hydrochloride

N-(6-amino-3-pyridinyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide;hydrochloride (PubChem CID 119515907) has the molecular formula C16H17ClF3N3O and a molecular weight of 359.78 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide;hydrochloride.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide;hydrochloride
PubChem CID119515907
Molecular FormulaC16H17ClF3N3O
Molecular Weight359.78 g/mol
Exact Mass359.10
IUPAC NameN-(6-amino-3-pyridinyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide;hydrochloride
SMILESCC(C)(C(=O)Nc1ccc(N)nc1)c1cccc(C(F)(F)F)c1.Cl
InChIInChI=1S/C16H16F3N3O.ClH/c1-15(2,10-4-3-5-11(8-10)16(17,18)19)14(23)22-12-6-7-13(20)21-9-12;/h3-9H,1-2H3,(H2,20,21)(H,22,23);1H
InChIKeySKVBILADGFCGBA-UHFFFAOYSA-N
XLogP4.02
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.78
LogP ≤ 54.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-amino-3-pyridinyl)-2-(4-ethylphenyl)-2-methylpropanamide;hydrochloride
CID 119515768
N-(2-amino-2-methylpropyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide
CID 119628714
2,2-dimethyl-N-[6-[3-(trifluoromethyl)anilino]-3-pyridinyl]propanamide
CID 110178309
2-[2-fluoro-4-[[2-methyl-2-[3-(trifluoromethyl)phenyl]propanoyl]amino]phenyl]acetic acid
CID 122109904
N-(6-amino-3-pyridinyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 62901879
N-(6-amino-3-pyridinyl)-2-(methanesulfonamido)-2-methylpropanamide
CID 119516146
2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide
CID 71371552
N-[1-[(6-amino-3-pyridinyl)amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride
CID 119516236
(2R)-3,3,3-trifluoro-2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide
CID 10542294
2-amino-5-chloro-N-[3-(trifluoromethyl)phenyl]pyridine-4-carboxamide
CID 114921483
N-(6-amino-3-pyridinyl)-2-(2-tert-butylphenoxy)acetamide;hydrochloride
CID 119515831
N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide
CID 113034847

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide;hydrochloride?
The IUPAC name of N-(6-amino-3-pyridinyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide;hydrochloride (CID 119515907) is N-(6-amino-3-pyridinyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide;hydrochloride.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide;hydrochloride?
The canonical SMILES for N-(6-amino-3-pyridinyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide;hydrochloride is CC(C)(C(=O)Nc1ccc(N)nc1)c1cccc(C(F)(F)F)c1.Cl.
What is the InChIKey of N-(6-amino-3-pyridinyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide;hydrochloride?
The InChIKey is SKVBILADGFCGBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F3N3O.ClH/c1-15(2,10-4-3-5-11(8-10)16(17,18)19)14(23)22-12-6-7-13(20)21-9-12;/h3-9H,1-2H3,(H2,20,21)(H,22,23);1H.
What are the key properties of N-(6-amino-3-pyridinyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide;hydrochloride?
N-(6-amino-3-pyridinyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide;hydrochloride has a molecular weight of 359.78 g/mol, XLogP of 4.02, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-2-methyl-2-[3-(trifluoromethyl)phenyl]propanamide;hydrochloride is sourced from PubChem (CID 119515907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).