1-[ethyl-[(1-methyltriazol-4-yl)methyl]amino]-2-methylpropan-2-ol

C10H20N4O — CID 103866967

IUPAC1-[ethyl-[(1-methyltriazol-4-yl)methyl]amino]-2-methylpropan-2-ol
SMILESCCN(Cc1cn(C)nn1)CC(C)(C)O
InChIInChI=1S/C10H20N4O/c1-5-14(8-10(2,3)15)7-9-6-13(4)12-11-9/h6,15H,5,7-8H2,1-4H3
InChIKeyWEFMEIVEJMSATQ-UHFFFAOYSA-N
MW212.30 g/mol
LogP0.41
Rot. Bonds5

About 1-[ethyl-[(1-methyltriazol-4-yl)methyl]amino]-2-methylpropan-2-ol

1-[ethyl-[(1-methyltriazol-4-yl)methyl]amino]-2-methylpropan-2-ol (PubChem CID 103866967) has the molecular formula C10H20N4O and a molecular weight of 212.30 g/mol. Its IUPAC name is 1-[ethyl-[(1-methyltriazol-4-yl)methyl]amino]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[ethyl-[(1-methyltriazol-4-yl)methyl]amino]-2-methylpropan-2-ol
PubChem CID103866967
Molecular FormulaC10H20N4O
Molecular Weight212.30 g/mol
Exact Mass212.16
IUPAC Name1-[ethyl-[(1-methyltriazol-4-yl)methyl]amino]-2-methylpropan-2-ol
SMILESCCN(Cc1cn(C)nn1)CC(C)(C)O
InChIInChI=1S/C10H20N4O/c1-5-14(8-10(2,3)15)7-9-6-13(4)12-11-9/h6,15H,5,7-8H2,1-4H3
InChIKeyWEFMEIVEJMSATQ-UHFFFAOYSA-N
XLogP0.41
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[ethyl-[(1-methyltriazol-4-yl)methyl]amino]-2-methylpropan-2-ol?
The IUPAC name of 1-[ethyl-[(1-methyltriazol-4-yl)methyl]amino]-2-methylpropan-2-ol (CID 103866967) is 1-[ethyl-[(1-methyltriazol-4-yl)methyl]amino]-2-methylpropan-2-ol.
What is the SMILES notation for 1-[ethyl-[(1-methyltriazol-4-yl)methyl]amino]-2-methylpropan-2-ol?
The canonical SMILES for 1-[ethyl-[(1-methyltriazol-4-yl)methyl]amino]-2-methylpropan-2-ol is CCN(Cc1cn(C)nn1)CC(C)(C)O.
What is the InChIKey of 1-[ethyl-[(1-methyltriazol-4-yl)methyl]amino]-2-methylpropan-2-ol?
The InChIKey is WEFMEIVEJMSATQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4O/c1-5-14(8-10(2,3)15)7-9-6-13(4)12-11-9/h6,15H,5,7-8H2,1-4H3.
What are the key properties of 1-[ethyl-[(1-methyltriazol-4-yl)methyl]amino]-2-methylpropan-2-ol?
1-[ethyl-[(1-methyltriazol-4-yl)methyl]amino]-2-methylpropan-2-ol has a molecular weight of 212.30 g/mol, XLogP of 0.41, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethyl-[(1-methyltriazol-4-yl)methyl]amino]-2-methylpropan-2-ol is sourced from PubChem (CID 103866967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).