(2-anilino-3-pyridinyl)-morpholin-4-ylmethanone

C16H17N3O2 — CID 1440870

IUPAC(2-anilino-3-pyridinyl)-morpholin-4-ylmethanone
SMILESO=C(c1cccnc1Nc1ccccc1)N1CCOCC1
InChIInChI=1S/C16H17N3O2/c20-16(19-9-11-21-12-10-19)14-7-4-8-17-15(14)18-13-5-2-1-3-6-13/h1-8H,9-12H2,(H,17,18)
InChIKeyGRPXBNJHMWMZEZ-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.30
Rot. Bonds3

About (2-anilino-3-pyridinyl)-morpholin-4-ylmethanone

(2-anilino-3-pyridinyl)-morpholin-4-ylmethanone (PubChem CID 1440870) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is (2-anilino-3-pyridinyl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(2-anilino-3-pyridinyl)-morpholin-4-ylmethanone
PubChem CID1440870
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name(2-anilino-3-pyridinyl)-morpholin-4-ylmethanone
SMILESO=C(c1cccnc1Nc1ccccc1)N1CCOCC1
InChIInChI=1S/C16H17N3O2/c20-16(19-9-11-21-12-10-19)14-7-4-8-17-15(14)18-13-5-2-1-3-6-13/h1-8H,9-12H2,(H,17,18)
InChIKeyGRPXBNJHMWMZEZ-UHFFFAOYSA-N
XLogP2.30
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-(2-fluoroanilino)pyridine-3-carbonyl]-1,4-oxazepane-6-carboxylic acid
CID 167791863
3-[[3-(morpholine-4-carbonyl)-2-pyridinyl]oxy]-N-phenylpyrrolidine-1-carboxamide
CID 91904308
[2-(3-fluoroanilino)-3-pyridinyl]-(4-phenoxypiperidin-1-yl)methanone
CID 86833930
[2-(3-fluoroanilino)-3-pyridinyl]-[4-(3-fluorophenyl)piperazin-1-yl]methanone
CID 166362766
[2-(3,4-dichloroanilino)-3-pyridinyl]-piperazin-1-ylmethanone
CID 119400835
3-[4-(morpholine-4-carbonyl)anilino]pyrazine-2-carboxamide
CID 144857846
(3-anilinopyrrolidin-1-yl)-[2-(4-ethoxyanilino)-3-pyridinyl]methanone
CID 56533430
[6-(isoquinolin-4-ylmethyl)-1,4-oxazepan-4-yl]-[2-(4-methoxyanilino)-3-pyridinyl]methanone
CID 110150505
[2-(4-ethoxyanilino)-3-pyridinyl]-[4-(4-hydroxyphenyl)piperazin-1-yl]methanone
CID 112799406
[1-(3,5-dichloroanilino)isoquinolin-4-yl]-morpholin-4-ylmethanone
CID 56960201
[2-(3,4-dimethoxyanilino)-3-pyridinyl]-piperidin-1-ylmethanone
CID 1431769
[2-[(4-methoxyoxan-4-yl)methylamino]-3-pyridinyl]-piperidin-1-ylmethanone
CID 133400100

Frequently Asked Questions

What is the IUPAC name of (2-anilino-3-pyridinyl)-morpholin-4-ylmethanone?
The IUPAC name of (2-anilino-3-pyridinyl)-morpholin-4-ylmethanone (CID 1440870) is (2-anilino-3-pyridinyl)-morpholin-4-ylmethanone.
What is the SMILES notation for (2-anilino-3-pyridinyl)-morpholin-4-ylmethanone?
The canonical SMILES for (2-anilino-3-pyridinyl)-morpholin-4-ylmethanone is O=C(c1cccnc1Nc1ccccc1)N1CCOCC1.
What is the InChIKey of (2-anilino-3-pyridinyl)-morpholin-4-ylmethanone?
The InChIKey is GRPXBNJHMWMZEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c20-16(19-9-11-21-12-10-19)14-7-4-8-17-15(14)18-13-5-2-1-3-6-13/h1-8H,9-12H2,(H,17,18).
What are the key properties of (2-anilino-3-pyridinyl)-morpholin-4-ylmethanone?
(2-anilino-3-pyridinyl)-morpholin-4-ylmethanone has a molecular weight of 283.33 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-anilino-3-pyridinyl)-morpholin-4-ylmethanone is sourced from PubChem (CID 1440870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).