2-(6-methylheptan-2-ylamino)ethanol

C10H23NO — CID 61469768

IUPAC2-(6-methylheptan-2-ylamino)ethanol
SMILESCC(C)CCCC(C)NCCO
InChIInChI=1S/C10H23NO/c1-9(2)5-4-6-10(3)11-7-8-12/h9-12H,4-8H2,1-3H3
InChIKeyJEZOPFKDGQDJDR-UHFFFAOYSA-N
MW173.30 g/mol
LogP1.78
Rot. Bonds7

About 2-(6-methylheptan-2-ylamino)ethanol

2-(6-methylheptan-2-ylamino)ethanol (PubChem CID 61469768) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 2-(6-methylheptan-2-ylamino)ethanol.

Molecular Properties

Compound Name2-(6-methylheptan-2-ylamino)ethanol
PubChem CID61469768
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name2-(6-methylheptan-2-ylamino)ethanol
SMILESCC(C)CCCC(C)NCCO
InChIInChI=1S/C10H23NO/c1-9(2)5-4-6-10(3)11-7-8-12/h9-12H,4-8H2,1-3H3
InChIKeyJEZOPFKDGQDJDR-UHFFFAOYSA-N
XLogP1.78
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(6-methylheptan-2-ylamino)ethanol 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

(2R)-6-methyl-N-(3-methylbutyl)heptan-2-amine
CID 38989018
2-methyl-6-(4-methylpentylamino)heptanoic acid
CID 83157356
(10R)-10-(2-hydroxyethylamino)undecanoic acid
CID 102119671
N,N-dimethyl-3-(6-methylheptan-2-ylamino)propanamide
CID 60765757
6-methyl-N-(5-methylhexan-2-yl)heptan-1-amine
CID 170090972
2-[2-(hexadecan-2-ylamino)ethylamino]ethanol
CID 102117969
(4R)-4-(octylamino)pentan-1-ol
CID 98118615
2-(6-methylheptylamino)ethanol
CID 23342125
3-(3-fluoropropylamino)butan-1-ol
CID 83177066
6-methyl-N-(2-methylbutyl)heptan-2-amine
CID 43106983
6-methyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]heptan-2-amine
CID 54962012
2-(5-thiophen-2-ylpentan-2-ylamino)ethanol
CID 83980472

Frequently Asked Questions

What is the IUPAC name of 2-(6-methylheptan-2-ylamino)ethanol?
The IUPAC name of 2-(6-methylheptan-2-ylamino)ethanol (CID 61469768) is 2-(6-methylheptan-2-ylamino)ethanol.
What is the SMILES notation for 2-(6-methylheptan-2-ylamino)ethanol?
The canonical SMILES for 2-(6-methylheptan-2-ylamino)ethanol is CC(C)CCCC(C)NCCO.
What is the InChIKey of 2-(6-methylheptan-2-ylamino)ethanol?
The InChIKey is JEZOPFKDGQDJDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-9(2)5-4-6-10(3)11-7-8-12/h9-12H,4-8H2,1-3H3.
What are the key properties of 2-(6-methylheptan-2-ylamino)ethanol?
2-(6-methylheptan-2-ylamino)ethanol has a molecular weight of 173.30 g/mol, XLogP of 1.78, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methylheptan-2-ylamino)ethanol is sourced from PubChem (CID 61469768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).