1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane

C13H26N2O — CID 142345337

IUPAC1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane
SMILESCC.CC1=CN(C)CC(NCC(C)(C)O)=C1
InChIInChI=1S/C11H20N2O.C2H6/c1-9-5-10(7-13(4)6-9)12-8-11(2,3)14;1-2/h5-6,12,14H,7-8H2,1-4H3;1-2H3
InChIKeyBURKIPXJOKCMSD-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.11
Rot. Bonds3

About 1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane

1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane (PubChem CID 142345337) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane.

Molecular Properties

Compound Name1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane
PubChem CID142345337
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane
SMILESCC.CC1=CN(C)CC(NCC(C)(C)O)=C1
InChIInChI=1S/C11H20N2O.C2H6/c1-9-5-10(7-13(4)6-9)12-8-11(2,3)14;1-2/h5-6,12,14H,7-8H2,1-4H3;1-2H3
InChIKeyBURKIPXJOKCMSD-UHFFFAOYSA-N
XLogP2.11
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-amino-2-butyl-5H-1,5-naphthyridin-1-yl)-2-methylpropan-2-ol
CID 22172669
1-(2-butyl-5H-1,5-naphthyridin-1-yl)-2-methylpropan-2-ol
CID 22172697
1-(2-butan-2-yl-5H-1,5-naphthyridin-1-yl)-2-methylpropan-2-ol
CID 23070492
2-[2-[(4,6-Dimethyl-1,2-dihydropyridin-3-yl)methyl-ethylamino]ethylamino]ethanol
CID 134406736
Ethane;2-methyl-1-[(5-methyl-1,2-dihydropyridin-3-yl)amino]propan-2-ol
CID 142345182
1-(Dimethylamino)-2-[(4-methylcyclohexa-1,3-dien-1-yl)amino]propan-2-ol
CID 144585256
ethane;(2E,4E)-3-methyl-5-[methyl-[2-(methylamino)ethyl]amino]hexa-2,4-dien-2-ol
CID 144840241
triethyl-[(Z,2Z)-2-(1-hydroxyethylidene)-4-(methylamino)pent-3-enyl]azanium
CID 146259255
3-[[(4Z,6Z)-3-methylideneocta-1,4,6-trien-2-yl]amino]prop-1-en-2-ol
CID 169612208
1-(Cyclohexa-1,5-dien-1-ylamino)-2-methylpropan-2-ol
CID 175763250
2-Methyl-1-[(5-methyl-1,2-dihydropyridin-3-yl)amino]propan-2-ol
CID 142345183
1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol
CID 142345338

Frequently Asked Questions

What is the IUPAC name of 1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane?
The IUPAC name of 1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane (CID 142345337) is 1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane.
What is the SMILES notation for 1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane?
The canonical SMILES for 1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane is CC.CC1=CN(C)CC(NCC(C)(C)O)=C1.
What is the InChIKey of 1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane?
The InChIKey is BURKIPXJOKCMSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O.C2H6/c1-9-5-10(7-13(4)6-9)12-8-11(2,3)14;1-2/h5-6,12,14H,7-8H2,1-4H3;1-2H3.
What are the key properties of 1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane?
1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane has a molecular weight of 226.36 g/mol, XLogP of 2.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1,5-dimethyl-2H-pyridin-3-yl)amino]-2-methylpropan-2-ol;ethane is sourced from PubChem (CID 142345337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).