4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide

C12H17N3O3 — CID 83095626

IUPAC4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide
SMILESCC(O)c1ccc(N2CCOCC2C(N)=O)nc1
InChIInChI=1S/C12H17N3O3/c1-8(16)9-2-3-11(14-6-9)15-4-5-18-7-10(15)12(13)17/h2-3,6,8,10,16H,4-5,7H2,1H3,(H2,13,17)
InChIKeyYUTJXOKRXPDUNS-UHFFFAOYSA-N
MW251.29 g/mol
LogP-0.17
Rot. Bonds3

About 4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide

4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide (PubChem CID 83095626) has the molecular formula C12H17N3O3 and a molecular weight of 251.29 g/mol. Its IUPAC name is 4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide.

Molecular Properties

Compound Name4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide
PubChem CID83095626
Molecular FormulaC12H17N3O3
Molecular Weight251.29 g/mol
Exact Mass251.13
IUPAC Name4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide
SMILESCC(O)c1ccc(N2CCOCC2C(N)=O)nc1
InChIInChI=1S/C12H17N3O3/c1-8(16)9-2-3-11(14-6-9)15-4-5-18-7-10(15)12(13)17/h2-3,6,8,10,16H,4-5,7H2,1H3,(H2,13,17)
InChIKeyYUTJXOKRXPDUNS-UHFFFAOYSA-N
XLogP-0.17
TPSA88.68 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[5-(aminomethyl)-2-pyridinyl]morpholine-3-carboxamide
CID 83102569
1-(6-morpholin-4-yl-3-pyridinyl)ethanol
CID 79886021
4-[3-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]morpholine-3-carboxamide
CID 83095812
4-N-[4-(1-hydroxyethyl)phenyl]morpholine-3,4-dicarboxamide
CID 83098981
4-[3-chloro-4-(1-hydroxyethyl)phenyl]morpholine-3-carboxamide
CID 83096321
4-(6-chloropyrazin-2-yl)morpholine-3-carboxamide
CID 83095551
4-(6-methyl-5-nitro-2-pyridinyl)morpholine-3-carboxamide
CID 133452657
4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide
CID 83107123
4-(4,6-dimethylpyrimidin-2-yl)morpholine-3-carboxamide
CID 75483897
[6-(3-methylmorpholin-4-yl)-3-pyridinyl]urea
CID 118333092
N-cyclopropyl-4-[4-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide
CID 83102212
6-[3-(propylcarbamoyl)morpholin-4-yl]pyridine-3-carboxylic acid
CID 83102742

Frequently Asked Questions

What is the IUPAC name of 4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide?
The IUPAC name of 4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide (CID 83095626) is 4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide.
What is the SMILES notation for 4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide?
The canonical SMILES for 4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide is CC(O)c1ccc(N2CCOCC2C(N)=O)nc1.
What is the InChIKey of 4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide?
The InChIKey is YUTJXOKRXPDUNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O3/c1-8(16)9-2-3-11(14-6-9)15-4-5-18-7-10(15)12(13)17/h2-3,6,8,10,16H,4-5,7H2,1H3,(H2,13,17).
What are the key properties of 4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide?
4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide has a molecular weight of 251.29 g/mol, XLogP of -0.17, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(1-hydroxyethyl)-2-pyridinyl]morpholine-3-carboxamide is sourced from PubChem (CID 83095626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).