4-(ethylamino)-6-methyl-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide

C15H23N3O2 — CID 81245640

IUPAC4-(ethylamino)-6-methyl-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide
SMILESCCNc1cc(C)ncc1C(=O)NCC1(C)CCCO1
InChIInChI=1S/C15H23N3O2/c1-4-16-13-8-11(2)17-9-12(13)14(19)18-10-15(3)6-5-7-20-15/h8-9H,4-7,10H2,1-3H3,(H,16,17)(H,18,19)
InChIKeyXHMCBHYGUADSFN-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.12
Rot. Bonds5

About 4-(ethylamino)-6-methyl-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide

4-(ethylamino)-6-methyl-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide (PubChem CID 81245640) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 4-(ethylamino)-6-methyl-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name4-(ethylamino)-6-methyl-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide
PubChem CID81245640
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name4-(ethylamino)-6-methyl-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide
SMILESCCNc1cc(C)ncc1C(=O)NCC1(C)CCCO1
InChIInChI=1S/C15H23N3O2/c1-4-16-13-8-11(2)17-9-12(13)14(19)18-10-15(3)6-5-7-20-15/h8-9H,4-7,10H2,1-3H3,(H,16,17)(H,18,19)
InChIKeyXHMCBHYGUADSFN-UHFFFAOYSA-N
XLogP2.12
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-4-[(2-methyloxolan-2-yl)methylamino]pyridine-3-carboxylic acid
CID 81243694
4-(ethylamino)-6-methyl-N-propylpyridine-3-carboxamide
CID 81236373
5-(ethylamino)-N-[(2-methyloxolan-2-yl)methyl]pyridine-2-carboxamide
CID 104641788
N-[2-(carbamoylamino)ethyl]-4-(ethylamino)-6-methylpyridine-3-carboxamide
CID 83114995
2-bromo-5-iodo-N-[(2-methyloxolan-2-yl)methyl]benzamide
CID 113362530
N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-4-(ethylamino)-6-methylpyridine-3-carboxamide
CID 106280158
4-(ethylamino)-6-methyl-N-(2-propan-2-yloxyethyl)pyridine-3-carboxamide
CID 104765505
4-(ethylamino)-6-methyl-N-(thian-2-ylmethyl)pyridine-3-carboxamide
CID 81246016
6-methyl-N-(1-methylcyclohexyl)-4-(propylamino)pyridine-3-carboxamide
CID 81238446
2,6-dichloro-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide
CID 103747169
5-bromo-2-hydroxy-N-[(2-methyloxolan-2-yl)methyl]benzamide
CID 103747166
4-(ethylamino)-6-methyl-N-(5-methylhexyl)pyridine-3-carboxamide
CID 115327297

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-6-methyl-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide?
The IUPAC name of 4-(ethylamino)-6-methyl-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide (CID 81245640) is 4-(ethylamino)-6-methyl-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 4-(ethylamino)-6-methyl-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 4-(ethylamino)-6-methyl-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide is CCNc1cc(C)ncc1C(=O)NCC1(C)CCCO1.
What is the InChIKey of 4-(ethylamino)-6-methyl-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide?
The InChIKey is XHMCBHYGUADSFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-4-16-13-8-11(2)17-9-12(13)14(19)18-10-15(3)6-5-7-20-15/h8-9H,4-7,10H2,1-3H3,(H,16,17)(H,18,19).
What are the key properties of 4-(ethylamino)-6-methyl-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide?
4-(ethylamino)-6-methyl-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 2.12, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-6-methyl-N-[(2-methyloxolan-2-yl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 81245640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).