6-[ethyl(methyl)amino]-2-methylhexan-2-ol

C10H23NO — CID 146593567

IUPAC6-[ethyl(methyl)amino]-2-methylhexan-2-ol
SMILESCCN(C)CCCCC(C)(C)O
InChIInChI=1S/C10H23NO/c1-5-11(4)9-7-6-8-10(2,3)12/h12H,5-9H2,1-4H3
InChIKeyDWNWYBMXXDNCQW-UHFFFAOYSA-N
MW173.30 g/mol
LogP1.88
Rot. Bonds6

About 6-[ethyl(methyl)amino]-2-methylhexan-2-ol

6-[ethyl(methyl)amino]-2-methylhexan-2-ol (PubChem CID 146593567) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 6-[ethyl(methyl)amino]-2-methylhexan-2-ol.

Molecular Properties

Compound Name6-[ethyl(methyl)amino]-2-methylhexan-2-ol
PubChem CID146593567
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name6-[ethyl(methyl)amino]-2-methylhexan-2-ol
SMILESCCN(C)CCCCC(C)(C)O
InChIInChI=1S/C10H23NO/c1-5-11(4)9-7-6-8-10(2,3)12/h12H,5-9H2,1-4H3
InChIKeyDWNWYBMXXDNCQW-UHFFFAOYSA-N
XLogP1.88
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-[ethyl(methyl)amino]-2-methylhexan-2-ol?
The IUPAC name of 6-[ethyl(methyl)amino]-2-methylhexan-2-ol (CID 146593567) is 6-[ethyl(methyl)amino]-2-methylhexan-2-ol.
What is the SMILES notation for 6-[ethyl(methyl)amino]-2-methylhexan-2-ol?
The canonical SMILES for 6-[ethyl(methyl)amino]-2-methylhexan-2-ol is CCN(C)CCCCC(C)(C)O.
What is the InChIKey of 6-[ethyl(methyl)amino]-2-methylhexan-2-ol?
The InChIKey is DWNWYBMXXDNCQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-5-11(4)9-7-6-8-10(2,3)12/h12H,5-9H2,1-4H3.
What are the key properties of 6-[ethyl(methyl)amino]-2-methylhexan-2-ol?
6-[ethyl(methyl)amino]-2-methylhexan-2-ol has a molecular weight of 173.30 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[ethyl(methyl)amino]-2-methylhexan-2-ol is sourced from PubChem (CID 146593567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).