2,6-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)pyridine-4-carboxamide

C19H29N3O3 — CID 138017093

IUPAC2,6-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)pyridine-4-carboxamide
SMILESCc1cc(C(=O)N(CCN2CCOCC2)C2CCOCC2)cc(C)n1
InChIInChI=1S/C19H29N3O3/c1-15-13-17(14-16(2)20-15)19(23)22(18-3-9-24-10-4-18)6-5-21-7-11-25-12-8-21/h13-14,18H,3-12H2,1-2H3
InChIKeyYGTDZTRGRIPTSW-UHFFFAOYSA-N
MW347.46 g/mol
LogP1.65
Rot. Bonds5

About 2,6-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)pyridine-4-carboxamide

2,6-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)pyridine-4-carboxamide (PubChem CID 138017093) has the molecular formula C19H29N3O3 and a molecular weight of 347.46 g/mol. Its IUPAC name is 2,6-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2,6-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)pyridine-4-carboxamide
PubChem CID138017093
Molecular FormulaC19H29N3O3
Molecular Weight347.46 g/mol
Exact Mass347.22
IUPAC Name2,6-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)pyridine-4-carboxamide
SMILESCc1cc(C(=O)N(CCN2CCOCC2)C2CCOCC2)cc(C)n1
InChIInChI=1S/C19H29N3O3/c1-15-13-17(14-16(2)20-15)19(23)22(18-3-9-24-10-4-18)6-5-21-7-11-25-12-8-21/h13-14,18H,3-12H2,1-2H3
InChIKeyYGTDZTRGRIPTSW-UHFFFAOYSA-N
XLogP1.65
TPSA54.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(4-Isopropyl-piperazin-1-yl)-(6-morpholin-4-ylmethylpyridin-3-yl)-methanone
CID 11588013
6-benzyl-2-N-methyl-4-N-(oxan-4-yl)pyridine-2,4-dicarboxamide
CID 138557106
[5-(Aminomethyl)-4-(4-fluorophenyl)-6-methyl-2-pyridinyl]-morpholin-4-ylmethanone
CID 53323866
(6-Methyl-2-pyridinyl)-[4-(2-propan-2-yloxyethyl)piperazin-1-yl]methanone
CID 72112635
9-Butanoyl-4-[(6-methyl-2-pyridinyl)methyl]-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 97471495
4-[(6-Methyl-2-pyridinyl)carbonyl]-2-(3-phenylpropyl)morpholine
CID 45238402
2,6-dimethyl-N-[cis-octahydro-2H,2'H-3,4'-bipyran-4-yl]isonicotinamide
CID 91765378
2-Methoxy-N-(oxan-4-YL)-N-[1-(pyridine-4-carbonyl)piperidin-4-YL]acetamide
CID 91906096
2-Methoxy-N-[1-(2-methylpyridine-3-carbonyl)piperidin-4-YL]-N-(oxan-4-YL)acetamide
CID 91906173
N-(Oxan-4-YL)-N-[1-(pyridine-4-carbonyl)piperidin-4-YL]propanamide
CID 91916161
N-Methyl-N-(oxan-4-YL)-1-(pyridine-4-carbonyl)piperidin-4-amine
CID 91916168
[4-(Diethylamino)-1-oxa-9-azaspiro[5.5]undecan-9-yl]-pyridin-4-ylmethanone
CID 91919112

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)pyridine-4-carboxamide?
The IUPAC name of 2,6-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)pyridine-4-carboxamide (CID 138017093) is 2,6-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2,6-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)pyridine-4-carboxamide?
The canonical SMILES for 2,6-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)pyridine-4-carboxamide is Cc1cc(C(=O)N(CCN2CCOCC2)C2CCOCC2)cc(C)n1.
What is the InChIKey of 2,6-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)pyridine-4-carboxamide?
The InChIKey is YGTDZTRGRIPTSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O3/c1-15-13-17(14-16(2)20-15)19(23)22(18-3-9-24-10-4-18)6-5-21-7-11-25-12-8-21/h13-14,18H,3-12H2,1-2H3.
What are the key properties of 2,6-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)pyridine-4-carboxamide?
2,6-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)pyridine-4-carboxamide has a molecular weight of 347.46 g/mol, XLogP of 1.65, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)pyridine-4-carboxamide is sourced from PubChem (CID 138017093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).