5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide

C11H13BrN2O — CID 62953692

IUPAC5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide
SMILESCCN(C(=O)c1ccc(Br)cn1)C1CC1
InChIInChI=1S/C11H13BrN2O/c1-2-14(9-4-5-9)11(15)10-6-3-8(12)7-13-10/h3,6-7,9H,2,4-5H2,1H3
InChIKeyNPDSQMASORYNHA-UHFFFAOYSA-N
MW269.14 g/mol
LogP2.47
Rot. Bonds3

About 5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide

5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide (PubChem CID 62953692) has the molecular formula C11H13BrN2O and a molecular weight of 269.14 g/mol. Its IUPAC name is 5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide
PubChem CID62953692
Molecular FormulaC11H13BrN2O
Molecular Weight269.14 g/mol
Exact Mass268.02
IUPAC Name5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide
SMILESCCN(C(=O)c1ccc(Br)cn1)C1CC1
InChIInChI=1S/C11H13BrN2O/c1-2-14(9-4-5-9)11(15)10-6-3-8(12)7-13-10/h3,6-7,9H,2,4-5H2,1H3
InChIKeyNPDSQMASORYNHA-UHFFFAOYSA-N
XLogP2.47
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.14
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-aminocyclohexyl)-5-bromo-N-propylpyridine-2-carboxamide
CID 79112080
N-(4-aminocyclohexyl)-5-chloro-N-ethylpyridine-2-carboxamide
CID 79115416
N-(4-aminocyclohexyl)-N-ethyl-5-fluoropyridine-2-carboxamide
CID 104639321
5-bromo-N-propyl-N-pyrrolidin-3-ylpyridine-2-carboxamide;dihydrochloride
CID 119531290
N-(4-aminocyclohexyl)-5-bromo-N-methylpyridine-2-carboxamide
CID 79121873
5-bromo-N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]pyridine-2-carboxamide
CID 62954767
5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide
CID 63723531
N-[(3-aminophenyl)methyl]-5-bromo-N-cyclopropylpyridine-2-carboxamide
CID 62960207
3-bromo-N-cyclopropyl-N-ethylbenzamide
CID 43243353
5-bromo-N-(2-chloroethyl)-N-ethylpyridine-2-carboxamide
CID 63395409
(5-bromo-2-pyridinyl)-[3-(diethylamino)pyrrolidin-1-yl]methanone
CID 63525317
3-[6-[cyclopentyl(ethyl)carbamoyl]-3-pyridinyl]prop-2-enoic acid
CID 76978678

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide?
The IUPAC name of 5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide (CID 62953692) is 5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide.
What is the SMILES notation for 5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide?
The canonical SMILES for 5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide is CCN(C(=O)c1ccc(Br)cn1)C1CC1.
What is the InChIKey of 5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide?
The InChIKey is NPDSQMASORYNHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrN2O/c1-2-14(9-4-5-9)11(15)10-6-3-8(12)7-13-10/h3,6-7,9H,2,4-5H2,1H3.
What are the key properties of 5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide?
5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide has a molecular weight of 269.14 g/mol, XLogP of 2.47, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-cyclopropyl-N-ethylpyridine-2-carboxamide is sourced from PubChem (CID 62953692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).