N-(2-pyridin-3-ylethyl)morpholine-4-carboxamide

C12H17N3O2 — CID 110872249

IUPACN-(2-pyridin-3-ylethyl)morpholine-4-carboxamide
SMILESO=C(NCCc1cccnc1)N1CCOCC1
InChIInChI=1S/C12H17N3O2/c16-12(15-6-8-17-9-7-15)14-5-3-11-2-1-4-13-10-11/h1-2,4,10H,3,5-9H2,(H,14,16)
InChIKeyCUMMASDTAHSGTR-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.67
Rot. Bonds3

About N-(2-pyridin-3-ylethyl)morpholine-4-carboxamide

N-(2-pyridin-3-ylethyl)morpholine-4-carboxamide (PubChem CID 110872249) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is N-(2-pyridin-3-ylethyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(2-pyridin-3-ylethyl)morpholine-4-carboxamide
PubChem CID110872249
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC NameN-(2-pyridin-3-ylethyl)morpholine-4-carboxamide
SMILESO=C(NCCc1cccnc1)N1CCOCC1
InChIInChI=1S/C12H17N3O2/c16-12(15-6-8-17-9-7-15)14-5-3-11-2-1-4-13-10-11/h1-2,4,10H,3,5-9H2,(H,14,16)
InChIKeyCUMMASDTAHSGTR-UHFFFAOYSA-N
XLogP0.67
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-morpholin-4-yl-3-oxo-N-(pyridin-3-ylmethyl)propanamide
CID 108943446
N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(pyridin-3-ylmethyl)piperazine-1-carboxamide
CID 71892889
2-methyl-N-(2-pyridin-3-ylethyl)spiro[indole-3,4'-piperidine]-1'-carboxamide
CID 136568238
N-propyl-4-(pyridin-3-ylmethyl)piperazine-1-carboxamide
CID 47139414
2-(hydroxymethyl)-N-(2-pyridin-3-ylethyl)pyrrolidine-1-carboxamide
CID 111427847
N-[1-(morpholine-4-carbonyl)piperidin-4-yl]-3-pyridin-3-ylpropanamide
CID 77081879
2-methyl-5-morpholin-4-ylsulfonyl-N-(2-pyridin-3-ylethyl)benzamide
CID 55555141
N-[2-(1,3-benzodioxol-5-yl)ethyl]morpholine-4-carboxamide
CID 34673472
4-[2-(1,4-oxazepane-4-carbonylamino)ethyl]benzoic acid
CID 62968342
8-methyl-N-(2-pyridin-3-ylethyl)-2-azaspiro[4.4]nonane-2-carboxamide
CID 146131989
2-(oxan-3-yl)-N-(2-pyridin-3-ylethyl)acetamide
CID 119062728
N-[(2S)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-3-pyridin-3-ylpropanamide
CID 99927332

Frequently Asked Questions

What is the IUPAC name of N-(2-pyridin-3-ylethyl)morpholine-4-carboxamide?
The IUPAC name of N-(2-pyridin-3-ylethyl)morpholine-4-carboxamide (CID 110872249) is N-(2-pyridin-3-ylethyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(2-pyridin-3-ylethyl)morpholine-4-carboxamide?
The canonical SMILES for N-(2-pyridin-3-ylethyl)morpholine-4-carboxamide is O=C(NCCc1cccnc1)N1CCOCC1.
What is the InChIKey of N-(2-pyridin-3-ylethyl)morpholine-4-carboxamide?
The InChIKey is CUMMASDTAHSGTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c16-12(15-6-8-17-9-7-15)14-5-3-11-2-1-4-13-10-11/h1-2,4,10H,3,5-9H2,(H,14,16).
What are the key properties of N-(2-pyridin-3-ylethyl)morpholine-4-carboxamide?
N-(2-pyridin-3-ylethyl)morpholine-4-carboxamide has a molecular weight of 235.29 g/mol, XLogP of 0.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyridin-3-ylethyl)morpholine-4-carboxamide is sourced from PubChem (CID 110872249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).