4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide

C13H21N3O2 — CID 62180315

IUPAC4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide
SMILESCCNc1ccnc(C(=O)N(C)C(C)COC)c1
InChIInChI=1S/C13H21N3O2/c1-5-14-11-6-7-15-12(8-11)13(17)16(3)10(2)9-18-4/h6-8,10H,5,9H2,1-4H3,(H,14,15)
InChIKeyPLKPMBIUDMLSOK-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.62
Rot. Bonds6

About 4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide

4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide (PubChem CID 62180315) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is 4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide
PubChem CID62180315
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide
SMILESCCNc1ccnc(C(=O)N(C)C(C)COC)c1
InChIInChI=1S/C13H21N3O2/c1-5-14-11-6-7-15-12(8-11)13(17)16(3)10(2)9-18-4/h6-8,10H,5,9H2,1-4H3,(H,14,15)
InChIKeyPLKPMBIUDMLSOK-UHFFFAOYSA-N
XLogP1.62
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-methoxypropan-2-yl)-N-methyl-4-(methylamino)pyridine-2-carboxamide
CID 62180314
4-(ethylamino)-N-methyl-N-pentan-2-ylpyridine-2-carboxamide
CID 62169428
N-(1-methoxypropan-2-yl)-N-methyl-5-(propylamino)pyridine-2-carboxamide
CID 104640516
4-(ethylamino)-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
CID 62180747
N-ethyl-2-[[1-methoxypropan-2-yl(methyl)amino]methyl]pyridin-4-amine
CID 79244322
N-(2-cyanoethyl)-4-(ethylamino)-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 63286908
2-chloro-N-[(2S)-1-methoxypropan-2-yl]-N-methylpyridine-4-carboxamide
CID 51891752
2-fluoro-N-(1-methoxypropan-2-yl)-N-methylpyridine-4-carboxamide
CID 61293111
N-[4-(dimethylamino)butan-2-yl]-4-(ethylamino)pyridine-2-carboxamide
CID 55046863
4-(2-hydroxypropylamino)-N,N-dimethylpyridine-2-carboxamide
CID 43395771
N-butan-2-yl-4-(ethylamino)pyridine-2-carboxamide
CID 62171647
N-(2-methoxyethyl)-4-(2-methylpropylamino)pyridine-2-carboxamide
CID 109203048

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide?
The IUPAC name of 4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide (CID 62180315) is 4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide?
The canonical SMILES for 4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide is CCNc1ccnc(C(=O)N(C)C(C)COC)c1.
What is the InChIKey of 4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide?
The InChIKey is PLKPMBIUDMLSOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-5-14-11-6-7-15-12(8-11)13(17)16(3)10(2)9-18-4/h6-8,10H,5,9H2,1-4H3,(H,14,15).
What are the key properties of 4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide?
4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide has a molecular weight of 251.33 g/mol, XLogP of 1.62, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-N-(1-methoxypropan-2-yl)-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 62180315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).