6-(3-morpholin-4-ylazetidin-1-yl)pyridine-3-carbonitrile

C13H16N4O — CID 175647980

IUPAC6-(3-morpholin-4-ylazetidin-1-yl)pyridine-3-carbonitrile
SMILESN#Cc1ccc(N2CC(N3CCOCC3)C2)nc1
InChIInChI=1S/C13H16N4O/c14-7-11-1-2-13(15-8-11)17-9-12(10-17)16-3-5-18-6-4-16/h1-2,8,12H,3-6,9-10H2
InChIKeySDURIGBCROZLQW-UHFFFAOYSA-N
MW244.30 g/mol
LogP0.47
Rot. Bonds2

About 6-(3-morpholin-4-ylazetidin-1-yl)pyridine-3-carbonitrile

6-(3-morpholin-4-ylazetidin-1-yl)pyridine-3-carbonitrile (PubChem CID 175647980) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is 6-(3-morpholin-4-ylazetidin-1-yl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(3-morpholin-4-ylazetidin-1-yl)pyridine-3-carbonitrile
PubChem CID175647980
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name6-(3-morpholin-4-ylazetidin-1-yl)pyridine-3-carbonitrile
SMILESN#Cc1ccc(N2CC(N3CCOCC3)C2)nc1
InChIInChI=1S/C13H16N4O/c14-7-11-1-2-13(15-8-11)17-9-12(10-17)16-3-5-18-6-4-16/h1-2,8,12H,3-6,9-10H2
InChIKeySDURIGBCROZLQW-UHFFFAOYSA-N
XLogP0.47
TPSA52.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 50.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-(3-morpholin-4-ylpiperidin-1-yl)pyridine-3-carbonitrile
CID 172899261
6-[3-(4-methylpiperazin-1-yl)azetidin-1-yl]pyridine-3-carbonitrile
CID 126891739
6-[4-(oxolan-3-yl)-1,4-diazepan-1-yl]pyridine-3-carbonitrile
CID 166602960
6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-3-carbonitrile
CID 95624717
fluoromethane;6-(4-pyrrolidin-1-ylpiperidin-1-yl)pyridine-3-carbonitrile
CID 169148538
3-(5-cyano-2-pyridinyl)-3,8-diazabicyclo[3.2.1]octane-8-carboxylic acid
CID 170168129
6-(3-pyrazol-1-ylpyrrolidin-1-yl)pyridine-3-carbonitrile
CID 126946418
6-(5-pyridin-2-yl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl)pyridine-3-carbonitrile
CID 163351951
6-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]pyridine-3-carbonitrile
CID 134051143
6-[2-(1-aminoethyl)morpholin-4-yl]pyridine-3-carbonitrile
CID 115315787
6-[4-(dimethylamino)piperidin-1-yl]pyridine-3-carbonitrile
CID 43430337
6-(4-propan-2-ylpiperidin-1-yl)pyridine-3-carbonitrile
CID 58431342

Frequently Asked Questions

What is the IUPAC name of 6-(3-morpholin-4-ylazetidin-1-yl)pyridine-3-carbonitrile?
The IUPAC name of 6-(3-morpholin-4-ylazetidin-1-yl)pyridine-3-carbonitrile (CID 175647980) is 6-(3-morpholin-4-ylazetidin-1-yl)pyridine-3-carbonitrile.
What is the SMILES notation for 6-(3-morpholin-4-ylazetidin-1-yl)pyridine-3-carbonitrile?
The canonical SMILES for 6-(3-morpholin-4-ylazetidin-1-yl)pyridine-3-carbonitrile is N#Cc1ccc(N2CC(N3CCOCC3)C2)nc1.
What is the InChIKey of 6-(3-morpholin-4-ylazetidin-1-yl)pyridine-3-carbonitrile?
The InChIKey is SDURIGBCROZLQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c14-7-11-1-2-13(15-8-11)17-9-12(10-17)16-3-5-18-6-4-16/h1-2,8,12H,3-6,9-10H2.
What are the key properties of 6-(3-morpholin-4-ylazetidin-1-yl)pyridine-3-carbonitrile?
6-(3-morpholin-4-ylazetidin-1-yl)pyridine-3-carbonitrile has a molecular weight of 244.30 g/mol, XLogP of 0.47, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-morpholin-4-ylazetidin-1-yl)pyridine-3-carbonitrile is sourced from PubChem (CID 175647980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).