N-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide

C16H18BrN3O2 — CID 119627181

IUPACN-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide
SMILESCC(C)(N)CNC(=O)c1cccnc1Oc1ccc(Br)cc1
InChIInChI=1S/C16H18BrN3O2/c1-16(2,18)10-20-14(21)13-4-3-9-19-15(13)22-12-7-5-11(17)6-8-12/h3-9H,10,18H2,1-2H3,(H,20,21)
InChIKeyZXEIWKPQSCQKID-UHFFFAOYSA-N
MW364.24 g/mol
LogP3.10
Rot. Bonds5

About N-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide

N-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide (PubChem CID 119627181) has the molecular formula C16H18BrN3O2 and a molecular weight of 364.24 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide
PubChem CID119627181
Molecular FormulaC16H18BrN3O2
Molecular Weight364.24 g/mol
Exact Mass363.06
IUPAC NameN-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide
SMILESCC(C)(N)CNC(=O)c1cccnc1Oc1ccc(Br)cc1
InChIInChI=1S/C16H18BrN3O2/c1-16(2,18)10-20-14(21)13-4-3-9-19-15(13)22-12-7-5-11(17)6-8-12/h3-9H,10,18H2,1-2H3,(H,20,21)
InChIKeyZXEIWKPQSCQKID-UHFFFAOYSA-N
XLogP3.10
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.24
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-amino-2,2-dimethylpropyl)-2-(4-bromophenoxy)-N-methylpyridine-3-carboxamide
CID 119653810
N-(2-hydroxy-2-methylpropyl)-2-methoxypyridine-3-carboxamide
CID 65109453
N-(3-bromo-2,2-dimethylpropyl)-2-methoxypyridine-3-carboxamide
CID 115364804
2-(4-bromophenoxy)-N-[(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]pyridine-3-carboxamide
CID 56576360
N-(2-amino-2-methylpropyl)-6-(4-bromophenoxy)pyridine-3-carboxamide;dihydrochloride
CID 119625868
2-(4-bromophenoxy)-N-[(1-ethylbenzimidazol-2-yl)methyl]pyridine-3-carboxamide
CID 55687355
2-(4-bromophenoxy)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]pyridine-3-carboxamide
CID 39283941
2-(4-bromophenoxy)-N-[(4-methylmorpholin-2-yl)methyl]pyridine-3-carboxamide
CID 51133314
2-(4-bromophenoxy)-N-(2-pyrrolidin-3-ylethyl)pyridine-3-carboxamide;dihydrochloride
CID 119534807
2-[4-[(4-bromophenyl)sulfonylamino]phenoxy]-N-prop-2-enylpyridine-3-carboxamide
CID 53120168
2-(4-bromophenoxy)-N-[(4S)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]pyridine-3-carboxamide
CID 100676572
2-[4-[(4-bromophenyl)sulfonylamino]phenoxy]-N-propan-2-ylpyridine-3-carboxamide
CID 53120166

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide?
The IUPAC name of N-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide (CID 119627181) is N-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide?
The canonical SMILES for N-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide is CC(C)(N)CNC(=O)c1cccnc1Oc1ccc(Br)cc1.
What is the InChIKey of N-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide?
The InChIKey is ZXEIWKPQSCQKID-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18BrN3O2/c1-16(2,18)10-20-14(21)13-4-3-9-19-15(13)22-12-7-5-11(17)6-8-12/h3-9H,10,18H2,1-2H3,(H,20,21).
What are the key properties of N-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide?
N-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide has a molecular weight of 364.24 g/mol, XLogP of 3.10, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-methylpropyl)-2-(4-bromophenoxy)pyridine-3-carboxamide is sourced from PubChem (CID 119627181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).