3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide

C12H16ClN3O2 — CID 71690241

IUPAC3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ncccc1Cl
InChIInChI=1S/C12H16ClN3O2/c13-10-2-1-3-14-11(10)12(17)15-4-5-16-6-8-18-9-7-16/h1-3H,4-9H2,(H,15,17)
InChIKeyHAZHNOHAQIBWCK-UHFFFAOYSA-N
MW269.73 g/mol
LogP0.80
Rot. Bonds4

About 3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide

3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide (PubChem CID 71690241) has the molecular formula C12H16ClN3O2 and a molecular weight of 269.73 g/mol. Its IUPAC name is 3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
PubChem CID71690241
Molecular FormulaC12H16ClN3O2
Molecular Weight269.73 g/mol
Exact Mass269.09
IUPAC Name3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ncccc1Cl
InChIInChI=1S/C12H16ClN3O2/c13-10-2-1-3-14-11(10)12(17)15-4-5-16-6-8-18-9-7-16/h1-3H,4-9H2,(H,15,17)
InChIKeyHAZHNOHAQIBWCK-UHFFFAOYSA-N
XLogP0.80
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.73
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 977791
2-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 799090
N-(2-morpholin-4-ylethyl)quinoline-8-carboxamide
CID 30370396
2-(2-chlorophenyl)-N-(2-morpholin-4-ylethyl)acetamide
CID 17217479
5-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109185766
2-(2-chloroanilino)-N-(2-morpholin-4-ylethyl)pyrimidine-4-carboxamide
CID 109301626
5-(2-chlorophenyl)-N-(2-morpholin-4-ylethyl)-1,2-oxazole-3-carboxamide
CID 1093869
N-(2-morpholin-4-ylethyl)-1,6-naphthyridine-8-carboxamide
CID 91949050
2-(2-chlorophenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide
CID 8009401
6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
CID 109115771
N-(2-morpholin-4-ylethyl)-1,3-oxazole-4-carboxamide
CID 110689462
3-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 669179

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide?
The IUPAC name of 3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide (CID 71690241) is 3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide is O=C(NCCN1CCOCC1)c1ncccc1Cl.
What is the InChIKey of 3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide?
The InChIKey is HAZHNOHAQIBWCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClN3O2/c13-10-2-1-3-14-11(10)12(17)15-4-5-16-6-8-18-9-7-16/h1-3H,4-9H2,(H,15,17).
What are the key properties of 3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide?
3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide has a molecular weight of 269.73 g/mol, XLogP of 0.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 71690241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).