2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide

C13H20N2O2 — CID 134005816

IUPAC2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)N(C)CC(C)C
InChIInChI=1S/C13H20N2O2/c1-5-17-12-11(7-6-8-14-12)13(16)15(4)9-10(2)3/h6-8,10H,5,9H2,1-4H3
InChIKeyRPSVDAICBDPUJJ-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.21
Rot. Bonds5

About 2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide

2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide (PubChem CID 134005816) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide
PubChem CID134005816
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide
SMILESCCOc1ncccc1C(=O)N(C)CC(C)C
InChIInChI=1S/C13H20N2O2/c1-5-17-12-11(7-6-8-14-12)13(16)15(4)9-10(2)3/h6-8,10H,5,9H2,1-4H3
InChIKeyRPSVDAICBDPUJJ-UHFFFAOYSA-N
XLogP2.21
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-N,N-dipropylpyridine-3-carboxamide
CID 78836443
N-[(5-bromofuran-2-yl)methyl]-2-ethoxy-N-methylpyridine-3-carboxamide
CID 51114491
N-(2-hydroxy-3-methoxypropyl)-2-methoxy-N-methylpyridine-3-carboxamide
CID 54993522
N-[(5-bromo-2-fluorophenyl)methyl]-2-ethoxy-N-methylpyridine-3-carboxamide
CID 55579968
2-ethoxy-N-[2-(4-fluoroanilino)-2-oxoethyl]-N-methylpyridine-3-carboxamide
CID 2468311
N-[(5-bromo-2-methoxyphenyl)methyl]-2-ethoxy-N-methylpyridine-3-carboxamide
CID 4786419
4-[(2-ethoxypyridine-3-carbonyl)amino]-3-methylbutanoic acid
CID 75446980
2-fluoro-N-methyl-N-(2-methylbutyl)pyridine-3-carboxamide
CID 107363082
N-(3-hydroxybutyl)-2-methoxy-N-methylpyridine-3-carboxamide
CID 113248565
3-hydroxy-N,2-dimethyl-N-(2-methylpropyl)benzamide
CID 82829951
N-[(1R,2R,3R)-2,3-dihydroxycycloheptyl]-2-ethoxy-N-methylpyridine-3-carboxamide
CID 110125877
2-[(2-methoxypyridine-3-carbonyl)-(2-methylpropyl)amino]acetic acid
CID 63072391

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide?
The IUPAC name of 2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide (CID 134005816) is 2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide?
The canonical SMILES for 2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide is CCOc1ncccc1C(=O)N(C)CC(C)C.
What is the InChIKey of 2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide?
The InChIKey is RPSVDAICBDPUJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-5-17-12-11(7-6-8-14-12)13(16)15(4)9-10(2)3/h6-8,10H,5,9H2,1-4H3.
What are the key properties of 2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide?
2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide has a molecular weight of 236.31 g/mol, XLogP of 2.21, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide is sourced from PubChem (CID 134005816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).