[2-[ethyl(2-methylprop-2-enyl)amino]-4,6-dimethyl-3-pyridinyl]methanol

C14H22N2O — CID 61255388

IUPAC[2-[ethyl(2-methylprop-2-enyl)amino]-4,6-dimethyl-3-pyridinyl]methanol
SMILESC=C(C)CN(CC)c1nc(C)cc(C)c1CO
InChIInChI=1S/C14H22N2O/c1-6-16(8-10(2)3)14-13(9-17)11(4)7-12(5)15-14/h7,17H,2,6,8-9H2,1,3-5H3
InChIKeyNHDDGEDMXPGLKK-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.59
Rot. Bonds5

About [2-[ethyl(2-methylprop-2-enyl)amino]-4,6-dimethyl-3-pyridinyl]methanol

[2-[ethyl(2-methylprop-2-enyl)amino]-4,6-dimethyl-3-pyridinyl]methanol (PubChem CID 61255388) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is [2-[ethyl(2-methylprop-2-enyl)amino]-4,6-dimethyl-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-[ethyl(2-methylprop-2-enyl)amino]-4,6-dimethyl-3-pyridinyl]methanol
PubChem CID61255388
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name[2-[ethyl(2-methylprop-2-enyl)amino]-4,6-dimethyl-3-pyridinyl]methanol
SMILESC=C(C)CN(CC)c1nc(C)cc(C)c1CO
InChIInChI=1S/C14H22N2O/c1-6-16(8-10(2)3)14-13(9-17)11(4)7-12(5)15-14/h7,17H,2,6,8-9H2,1,3-5H3
InChIKeyNHDDGEDMXPGLKK-UHFFFAOYSA-N
XLogP2.59
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

3-[(cyclopropylamino)methyl]-N-ethyl-4,6-dimethyl-N-(2-methylprop-2-enyl)pyridin-2-amine
CID 62279990
4-N-ethyl-6-methyl-4-N-(2-methylprop-2-enyl)pyrimidine-2,4-diamine
CID 103817578
N-ethyl-3-(ethylaminomethyl)-4,6-dimethyl-N-(2-methylpropyl)pyridin-2-amine
CID 62280772
[2-[cyclopentyl(methyl)amino]-4,6-dimethyl-3-pyridinyl]methanol
CID 61256024
3-(chloromethyl)-N-ethyl-4,6-dimethyl-N-(2-methylpropyl)pyridin-2-amine
CID 61256392
[2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethyl-3-pyridinyl]methanol
CID 61255211
[2-[cyclohexyl(methyl)amino]-4,6-dimethyl-3-pyridinyl]methanol
CID 61252783
3-(aminomethyl)-N-benzyl-N-ethyl-4,6-dimethylpyridin-2-amine
CID 61175356
[2-[cyclopentylmethyl(methyl)amino]-4,6-dimethyl-3-pyridinyl]methanol
CID 63631450
2-(diethylamino)-4,6-dimethylpyridine-3-carbothioamide
CID 61177282
[2-[1-(2-fluorophenyl)ethyl-methylamino]-4,6-dimethyl-3-pyridinyl]methanol
CID 62984852
3-(chloromethyl)-N-(cyclobutylmethyl)-N-ethyl-4,6-dimethylpyridin-2-amine
CID 107400692

Frequently Asked Questions

What is the IUPAC name of [2-[ethyl(2-methylprop-2-enyl)amino]-4,6-dimethyl-3-pyridinyl]methanol?
The IUPAC name of [2-[ethyl(2-methylprop-2-enyl)amino]-4,6-dimethyl-3-pyridinyl]methanol (CID 61255388) is [2-[ethyl(2-methylprop-2-enyl)amino]-4,6-dimethyl-3-pyridinyl]methanol.
What is the SMILES notation for [2-[ethyl(2-methylprop-2-enyl)amino]-4,6-dimethyl-3-pyridinyl]methanol?
The canonical SMILES for [2-[ethyl(2-methylprop-2-enyl)amino]-4,6-dimethyl-3-pyridinyl]methanol is C=C(C)CN(CC)c1nc(C)cc(C)c1CO.
What is the InChIKey of [2-[ethyl(2-methylprop-2-enyl)amino]-4,6-dimethyl-3-pyridinyl]methanol?
The InChIKey is NHDDGEDMXPGLKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-6-16(8-10(2)3)14-13(9-17)11(4)7-12(5)15-14/h7,17H,2,6,8-9H2,1,3-5H3.
What are the key properties of [2-[ethyl(2-methylprop-2-enyl)amino]-4,6-dimethyl-3-pyridinyl]methanol?
[2-[ethyl(2-methylprop-2-enyl)amino]-4,6-dimethyl-3-pyridinyl]methanol has a molecular weight of 234.34 g/mol, XLogP of 2.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[ethyl(2-methylprop-2-enyl)amino]-4,6-dimethyl-3-pyridinyl]methanol is sourced from PubChem (CID 61255388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).