1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol

C12H20N2O — CID 61449194

IUPAC1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol
SMILESCCN(Cc1ccncc1)CC(C)(C)O
InChIInChI=1S/C12H20N2O/c1-4-14(10-12(2,3)15)9-11-5-7-13-8-6-11/h5-8,15H,4,9-10H2,1-3H3
InChIKeyAKXYDCSCQBLTFU-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.67
Rot. Bonds5

About 1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol

1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol (PubChem CID 61449194) has the molecular formula C12H20N2O and a molecular weight of 208.31 g/mol. Its IUPAC name is 1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol
PubChem CID61449194
Molecular FormulaC12H20N2O
Molecular Weight208.31 g/mol
Exact Mass208.16
IUPAC Name1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol
SMILESCCN(Cc1ccncc1)CC(C)(C)O
InChIInChI=1S/C12H20N2O/c1-4-14(10-12(2,3)15)9-11-5-7-13-8-6-11/h5-8,15H,4,9-10H2,1-3H3
InChIKeyAKXYDCSCQBLTFU-UHFFFAOYSA-N
XLogP1.67
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol 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-[ethyl(pyridin-4-ylmethyl)amino]-2-methylbutan-2-ol
CID 114495467
1-N-ethyl-2-methyl-1-N-(pyridin-4-ylmethyl)propane-1,2-diamine
CID 61449476
1-[(4-chlorophenyl)methyl-ethylamino]-2-methylpropan-2-ol
CID 78962077
1-[ethyl-[[2-(ethylamino)-4-pyridinyl]methyl]amino]-2-methylpropan-2-ol
CID 79376914
1-N-ethyl-3-methyl-1-N-(pyridin-4-ylmethyl)butane-1,3-diamine
CID 64677497
1-[(3,4-dimethylphenyl)methyl-ethylamino]-2-methylpropan-2-ol
CID 79389462
1-[ethyl(pyrazin-2-ylmethyl)amino]-2-methylpropan-2-ol
CID 79389752
1-N-ethyl-3,3-dimethyl-1-N-(pyridin-4-ylmethyl)butane-1,2-diamine
CID 54948462
1-[2,3-dihydro-1H-inden-5-ylmethyl(ethyl)amino]-2-methylpropan-2-ol
CID 78966629
N-ethyl-3-iodo-N-(pyridin-4-ylmethyl)propan-1-amine
CID 142257786
1-chloro-3-[ethyl(pyridin-4-ylmethyl)amino]propan-2-ol
CID 112561407
N-tert-butyl-N'-ethyl-N'-(pyridin-4-ylmethyl)pentane-1,5-diamine
CID 62430607

Frequently Asked Questions

What is the IUPAC name of 1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol?
The IUPAC name of 1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol (CID 61449194) is 1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol.
What is the SMILES notation for 1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol?
The canonical SMILES for 1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol is CCN(Cc1ccncc1)CC(C)(C)O.
What is the InChIKey of 1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol?
The InChIKey is AKXYDCSCQBLTFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-4-14(10-12(2,3)15)9-11-5-7-13-8-6-11/h5-8,15H,4,9-10H2,1-3H3.
What are the key properties of 1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol?
1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol has a molecular weight of 208.31 g/mol, XLogP of 1.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethyl(pyridin-4-ylmethyl)amino]-2-methylpropan-2-ol is sourced from PubChem (CID 61449194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).