2-[methyl(prop-1-en-2-yl)amino]ethanol

C6H13NO — CID 123488296

IUPAC2-[methyl(prop-1-en-2-yl)amino]ethanol
SMILESC=C(C)N(C)CCO
InChIInChI=1S/C6H13NO/c1-6(2)7(3)4-5-8/h8H,1,4-5H2,2-3H3
InChIKeyMWPQMXCPSQNKHO-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.44
Rot. Bonds3

About 2-[methyl(prop-1-en-2-yl)amino]ethanol

2-[methyl(prop-1-en-2-yl)amino]ethanol (PubChem CID 123488296) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is 2-[methyl(prop-1-en-2-yl)amino]ethanol.

Molecular Properties

Compound Name2-[methyl(prop-1-en-2-yl)amino]ethanol
PubChem CID123488296
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name2-[methyl(prop-1-en-2-yl)amino]ethanol
SMILESC=C(C)N(C)CCO
InChIInChI=1S/C6H13NO/c1-6(2)7(3)4-5-8/h8H,1,4-5H2,2-3H3
InChIKeyMWPQMXCPSQNKHO-UHFFFAOYSA-N
XLogP0.44
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(1-Methylethenyl)amino]ethanol
CID 15413083
2-[2-Hydroxyethyl(prop-1-en-2-yl)amino]ethanol
CID 45088074
N-(2-methoxyethyl)-N-methylprop-1-en-2-amine
CID 58166103
2-[But-1-en-2-yl(methyl)amino]ethanol
CID 58166114
2-(Dimethylamino)prop-2-en-1-ol
CID 59926244
2-[Buta-1,3-dien-2-yl(methyl)amino]ethanol
CID 89245946
2-[3-Iodopropyl(methyl)amino]prop-2-en-1-ol
CID 89946150
2-[4-Iodobut-1-en-2-yl(methyl)amino]ethanol
CID 89946153
2-[Ethyl(prop-1-en-2-yl)amino]ethanol
CID 118426590
1-[Prop-1-en-2-yl(propyl)amino]ethanol
CID 123217766
2-[[(E)-but-2-en-2-yl]-methylamino]ethanol
CID 130193982
2-[methyl-[(2E)-penta-2,4-dien-2-yl]amino]ethanol
CID 139315194

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(prop-1-en-2-yl)amino]ethanol?
The IUPAC name of 2-[methyl(prop-1-en-2-yl)amino]ethanol (CID 123488296) is 2-[methyl(prop-1-en-2-yl)amino]ethanol.
What is the SMILES notation for 2-[methyl(prop-1-en-2-yl)amino]ethanol?
The canonical SMILES for 2-[methyl(prop-1-en-2-yl)amino]ethanol is C=C(C)N(C)CCO.
What is the InChIKey of 2-[methyl(prop-1-en-2-yl)amino]ethanol?
The InChIKey is MWPQMXCPSQNKHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-6(2)7(3)4-5-8/h8H,1,4-5H2,2-3H3.
What are the key properties of 2-[methyl(prop-1-en-2-yl)amino]ethanol?
2-[methyl(prop-1-en-2-yl)amino]ethanol has a molecular weight of 115.18 g/mol, XLogP of 0.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(prop-1-en-2-yl)amino]ethanol is sourced from PubChem (CID 123488296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).