N-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide

C16H19N3O2 — CID 82331090

IUPACN-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide
SMILESCc1nc(N)ccc1NC(=O)c1ccc(OC(C)C)cc1
InChIInChI=1S/C16H19N3O2/c1-10(2)21-13-6-4-12(5-7-13)16(20)19-14-8-9-15(17)18-11(14)3/h4-10H,1-3H3,(H2,17,18)(H,19,20)
InChIKeyJQMNSVBNUOCKTI-UHFFFAOYSA-N
MW285.35 g/mol
LogP3.01
Rot. Bonds4

About N-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide

N-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide (PubChem CID 82331090) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide.

Molecular Properties

Compound NameN-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide
PubChem CID82331090
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide
SMILESCc1nc(N)ccc1NC(=O)c1ccc(OC(C)C)cc1
InChIInChI=1S/C16H19N3O2/c1-10(2)21-13-6-4-12(5-7-13)16(20)19-14-8-9-15(17)18-11(14)3/h4-10H,1-3H3,(H2,17,18)(H,19,20)
InChIKeyJQMNSVBNUOCKTI-UHFFFAOYSA-N
XLogP3.01
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxy-4-methylphenyl)-4-propan-2-yloxybenzamide
CID 27681755
4-amino-N-(4-propan-2-yloxyphenyl)benzamide
CID 28722589
N-(3-chloro-2-methylphenyl)-4-propan-2-yloxybenzamide
CID 886785
4-(methylamino)-N-(4-propan-2-yloxyphenyl)benzamide
CID 62166478
2-amino-4-methyl-N-(2-methyl-4-propan-2-yloxyphenyl)-1,3-thiazole-5-carboxamide
CID 62792917
4-propan-2-yloxy-N-(3-propan-2-yloxyphenyl)benzamide
CID 17154760
N-naphthalen-2-yl-4-propan-2-yloxybenzamide
CID 823400
N-(2,5-dimethylpyrazol-3-yl)-4-propan-2-yloxybenzamide
CID 45284563
tert-butyl N-(6-amino-2-methyl-3-pyridinyl)carbamate
CID 82342800
N-(3,5-dibromo-4-hydroxyphenyl)-4-propan-2-yloxybenzamide
CID 5119029
propan-2-yl 2-[4-[(2,4-dimethylphenyl)carbamoyl]phenoxy]propanoate
CID 3712073
4-propan-2-yloxy-N-[2-[(4-propan-2-yloxybenzoyl)amino]ethyl]benzamide
CID 4952415

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide?
The IUPAC name of N-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide (CID 82331090) is N-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide.
What is the SMILES notation for N-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide?
The canonical SMILES for N-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide is Cc1nc(N)ccc1NC(=O)c1ccc(OC(C)C)cc1.
What is the InChIKey of N-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide?
The InChIKey is JQMNSVBNUOCKTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-10(2)21-13-6-4-12(5-7-13)16(20)19-14-8-9-15(17)18-11(14)3/h4-10H,1-3H3,(H2,17,18)(H,19,20).
What are the key properties of N-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide?
N-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide has a molecular weight of 285.35 g/mol, XLogP of 3.01, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide is sourced from PubChem (CID 82331090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).