4-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide

C16H20N4O2 — CID 155975370

IUPAC4-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide
SMILESCc1cc(C)c(C#N)c(N2CCOC(C(=O)NC3CC3)C2)n1
InChIInChI=1S/C16H20N4O2/c1-10-7-11(2)18-15(13(10)8-17)20-5-6-22-14(9-20)16(21)19-12-3-4-12/h7,12,14H,3-6,9H2,1-2H3,(H,19,21)
InChIKeyJHWYHGOFRHSQFQ-UHFFFAOYSA-N
MW300.36 g/mol
LogP1.05
Rot. Bonds3

About 4-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide

4-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide (PubChem CID 155975370) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 4-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide.

Molecular Properties

Compound Name4-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide
PubChem CID155975370
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name4-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide
SMILESCc1cc(C)c(C#N)c(N2CCOC(C(=O)NC3CC3)C2)n1
InChIInChI=1S/C16H20N4O2/c1-10-7-11(2)18-15(13(10)8-17)20-5-6-22-14(9-20)16(21)19-12-3-4-12/h7,12,14H,3-6,9H2,1-2H3,(H,19,21)
InChIKeyJHWYHGOFRHSQFQ-UHFFFAOYSA-N
XLogP1.05
TPSA78.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4,6-dimethyl-2-[2-(thiomorpholine-4-carbonyl)morpholin-4-yl]pyridine-3-carbonitrile
CID 154583149
1-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-(oxan-4-yl)piperidine-4-carboxamide
CID 171992627
4-(3-cyanopyrazin-2-yl)-N-cyclopropylmorpholine-2-carboxamide
CID 155942303
N-cyclopropyl-4-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)morpholine-2-carboxamide
CID 155799885
2-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)morpholin-4-yl]-4,6-dimethylpyridine-3-carbonitrile
CID 172881275
N-tert-butyl-1-(3-cyano-4,6-dimethyl-2-pyridinyl)pyrrolidine-3-carboxamide
CID 155799749
4-(5-cyano-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide
CID 155942289
2-(3-hydroxypiperidin-1-yl)-4,6-dimethylpyridine-3-carbonitrile
CID 60658799
1-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-propan-2-ylpiperidine-4-carboxamide
CID 171992682
2-(3-formylpiperidin-1-yl)-4,6-dimethylpyridine-3-carbonitrile
CID 55100699
N-cyclopropyl-4-(6-methoxy-2-pyridinyl)morpholine-2-carboxamide
CID 172890955
2-(azetidin-1-yl)-4,6-dimethylpyridine-3-carbonitrile
CID 130547075

Frequently Asked Questions

What is the IUPAC name of 4-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide?
The IUPAC name of 4-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide (CID 155975370) is 4-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide.
What is the SMILES notation for 4-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide?
The canonical SMILES for 4-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide is Cc1cc(C)c(C#N)c(N2CCOC(C(=O)NC3CC3)C2)n1.
What is the InChIKey of 4-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide?
The InChIKey is JHWYHGOFRHSQFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-10-7-11(2)18-15(13(10)8-17)20-5-6-22-14(9-20)16(21)19-12-3-4-12/h7,12,14H,3-6,9H2,1-2H3,(H,19,21).
What are the key properties of 4-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide?
4-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide has a molecular weight of 300.36 g/mol, XLogP of 1.05, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyano-4,6-dimethyl-2-pyridinyl)-N-cyclopropylmorpholine-2-carboxamide is sourced from PubChem (CID 155975370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).