2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide

C11H14BrN3O2 — CID 62187031

IUPAC2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide
SMILESNc1ncc(Br)cc1C(=O)N(CCO)C1CC1
InChIInChI=1S/C11H14BrN3O2/c12-7-5-9(10(13)14-6-7)11(17)15(3-4-16)8-1-2-8/h5-6,8,16H,1-4H2,(H2,13,14)
InChIKeyQCKPRRKKSZYRBG-UHFFFAOYSA-N
MW300.16 g/mol
LogP1.02
Rot. Bonds4

About 2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide

2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide (PubChem CID 62187031) has the molecular formula C11H14BrN3O2 and a molecular weight of 300.16 g/mol. Its IUPAC name is 2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide
PubChem CID62187031
Molecular FormulaC11H14BrN3O2
Molecular Weight300.16 g/mol
Exact Mass299.03
IUPAC Name2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide
SMILESNc1ncc(Br)cc1C(=O)N(CCO)C1CC1
InChIInChI=1S/C11H14BrN3O2/c12-7-5-9(10(13)14-6-7)11(17)15(3-4-16)8-1-2-8/h5-6,8,16H,1-4H2,(H2,13,14)
InChIKeyQCKPRRKKSZYRBG-UHFFFAOYSA-N
XLogP1.02
TPSA79.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.16
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-5-bromo-N-cyclopentyl-N-ethylpyridine-3-carboxamide
CID 62153959
5-bromo-N-cyclobutyl-2-hydrazinyl-N-(2-hydroxyethyl)pyridine-3-carboxamide
CID 102870609
3-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)-2-methylbenzamide
CID 114011338
2-amino-5-bromo-N-cycloheptyl-N-methylpyridine-3-carboxamide
CID 55042078
4-bromo-N-cyclopropyl-N-(2-hydroxyethyl)-2-sulfanylbenzamide
CID 107026297
5-amino-2-bromo-N-cyclopropyl-4-fluoro-N-(2-hydroxyethyl)benzamide
CID 62816289
2-amino-5-chloro-N-cyclopropyl-N-(2-hydroxyethyl)benzamide
CID 43575514
2-amino-N-(1-bicyclo[1.1.1]pentanyl)-5-bromo-N-methylpyridine-3-carboxamide
CID 118238040
(2-amino-5-bromo-3-pyridinyl)-cyclopentylmethanone
CID 59699866
6-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide
CID 66462316
2-amino-5-bromo-N-cyclobutyl-N-(3-hydroxypropyl)benzamide
CID 102864994
3-amino-4-bromo-N-cyclopropyl-N-(2-hydroxyethyl)benzamide
CID 61095056

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide?
The IUPAC name of 2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide (CID 62187031) is 2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide is Nc1ncc(Br)cc1C(=O)N(CCO)C1CC1.
What is the InChIKey of 2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide?
The InChIKey is QCKPRRKKSZYRBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrN3O2/c12-7-5-9(10(13)14-6-7)11(17)15(3-4-16)8-1-2-8/h5-6,8,16H,1-4H2,(H2,13,14).
What are the key properties of 2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide?
2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide has a molecular weight of 300.16 g/mol, XLogP of 1.02, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-bromo-N-cyclopropyl-N-(2-hydroxyethyl)pyridine-3-carboxamide is sourced from PubChem (CID 62187031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).