2-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide

C16H19N3O2 — CID 62328427

IUPAC2-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide
SMILESCCC(C)Oc1cccc(NC(=O)c2ccnc(N)c2)c1
InChIInChI=1S/C16H19N3O2/c1-3-11(2)21-14-6-4-5-13(10-14)19-16(20)12-7-8-18-15(17)9-12/h4-11H,3H2,1-2H3,(H2,17,18)(H,19,20)
InChIKeyMYAYOFULFKUZHA-UHFFFAOYSA-N
MW285.35 g/mol
LogP3.09
Rot. Bonds5

About 2-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide

2-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide (PubChem CID 62328427) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide
PubChem CID62328427
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name2-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide
SMILESCCC(C)Oc1cccc(NC(=O)c2ccnc(N)c2)c1
InChIInChI=1S/C16H19N3O2/c1-3-11(2)21-14-6-4-5-13(10-14)19-16(20)12-7-8-18-15(17)9-12/h4-11H,3H2,1-2H3,(H2,17,18)(H,19,20)
InChIKeyMYAYOFULFKUZHA-UHFFFAOYSA-N
XLogP3.09
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 3-[(3-butan-2-yloxyphenyl)carbamoyl]benzoate
CID 17175369
3-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide
CID 105069782
methyl 4-[(3-butan-2-yloxyphenyl)carbamoyl]benzoate
CID 17178329
3-butan-2-yloxy-N-(3-methylphenyl)benzamide
CID 17149681
3-butan-2-yloxy-N-[3-(3-methylbutoxy)phenyl]benzamide
CID 17149831
N-(3-butan-2-yloxyphenyl)-3-(2-methylprop-2-enoxy)benzamide
CID 17161663
3-[(2S)-butan-2-yl]oxy-N-[3-(propanoylamino)phenyl]benzamide
CID 40976698
3-butan-2-yloxy-N-(3-chlorophenyl)benzamide
CID 17149674
N-(3-butan-2-yloxyphenyl)-4-(2-ethoxyethoxy)benzamide
CID 17161659
2-(3-butan-2-yloxyanilino)pyridine-4-carbothioamide
CID 62327209
3-amino-N-(3-butan-2-yloxyphenyl)-5-methyl-1H-pyrazole-4-carboxamide
CID 62329109
4-butan-2-yloxy-N-(3-hexoxyphenyl)benzamide
CID 17141337

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide (CID 62328427) is 2-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide is CCC(C)Oc1cccc(NC(=O)c2ccnc(N)c2)c1.
What is the InChIKey of 2-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide?
The InChIKey is MYAYOFULFKUZHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-3-11(2)21-14-6-4-5-13(10-14)19-16(20)12-7-8-18-15(17)9-12/h4-11H,3H2,1-2H3,(H2,17,18)(H,19,20).
What are the key properties of 2-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide?
2-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 3.09, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-butan-2-yloxyphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 62328427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).