2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide

C17H19N3O2 — CID 50967003

IUPAC2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide
SMILESNC(=O)c1ccnc(-c2ccccc2CN2CCOCC2)c1
InChIInChI=1S/C17H19N3O2/c18-17(21)13-5-6-19-16(11-13)15-4-2-1-3-14(15)12-20-7-9-22-10-8-20/h1-6,11H,7-10,12H2,(H2,18,21)
InChIKeyGYHOFFSORGLOPF-UHFFFAOYSA-N
MW297.36 g/mol
LogP1.68
Rot. Bonds4

About 2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide

2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide (PubChem CID 50967003) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is 2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide
PubChem CID50967003
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC Name2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide
SMILESNC(=O)c1ccnc(-c2ccccc2CN2CCOCC2)c1
InChIInChI=1S/C17H19N3O2/c18-17(21)13-5-6-19-16(11-13)15-4-2-1-3-14(15)12-20-7-9-22-10-8-20/h1-6,11H,7-10,12H2,(H2,18,21)
InChIKeyGYHOFFSORGLOPF-UHFFFAOYSA-N
XLogP1.68
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethoxy-4-(morpholin-4-ylmethyl)benzamide
CID 68978840
2-morpholin-4-yl-6-[2-(morpholin-4-ylmethyl)phenyl]pyrimidin-4-amine
CID 74235769
[2-[4-(morpholine-4-carbonyl)-2-pyridinyl]-4-pyridinyl]-morpholin-4-ylmethanone
CID 171623322
4-[[2-[4-(2,6-dimethyl-3-pyridinyl)pyrimidin-2-yl]phenyl]methyl]morpholine
CID 56872749
3-[[16-[(2-carboxy-3-pyridinyl)methyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]methyl]pyridine-2-carboxylic acid
CID 174155383
N-ethyl-6-[2-(morpholin-4-ylmethyl)phenyl]pyridazin-3-amine
CID 72889282
CID 131887032
CID 131887032
2-(morpholin-4-ylmethyl)benzohydrazide
CID 28985199
2,2-dichloro-N-[3-[3-[2-(morpholin-4-ylmethyl)phenyl]-1,2-oxazol-5-yl]phenyl]acetamide
CID 10138515
4-[[2-(3H-benzimidazol-5-yl)phenyl]methyl]morpholine
CID 29185404
3-methyl-6-[4-[2-(morpholin-4-ylmethyl)phenyl]phenyl]benzotriazole-4-carboxylic acid
CID 85469018
N-[5-[2-(morpholin-4-ylmethyl)phenyl]quinolin-8-yl]acetamide
CID 50964889

Frequently Asked Questions

What is the IUPAC name of 2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide?
The IUPAC name of 2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide (CID 50967003) is 2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide?
The canonical SMILES for 2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide is NC(=O)c1ccnc(-c2ccccc2CN2CCOCC2)c1.
What is the InChIKey of 2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide?
The InChIKey is GYHOFFSORGLOPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c18-17(21)13-5-6-19-16(11-13)15-4-2-1-3-14(15)12-20-7-9-22-10-8-20/h1-6,11H,7-10,12H2,(H2,18,21).
What are the key properties of 2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide?
2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide has a molecular weight of 297.36 g/mol, XLogP of 1.68, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(morpholin-4-ylmethyl)phenyl]pyridine-4-carboxamide is sourced from PubChem (CID 50967003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).