2-[di(propan-2-yl)amino]ethanol;methane

C9H23NO — CID 145105271

IUPAC2-[di(propan-2-yl)amino]ethanol;methane
SMILESC.CC(C)N(CCO)C(C)C
InChIInChI=1S/C8H19NO.CH4/c1-7(2)9(5-6-10)8(3)4;/h7-8,10H,5-6H2,1-4H3;1H4
InChIKeyMNMQAHCWLDTKGU-UHFFFAOYSA-N
MW161.29 g/mol
LogP1.73
Rot. Bonds4

About 2-[di(propan-2-yl)amino]ethanol;methane

2-[di(propan-2-yl)amino]ethanol;methane (PubChem CID 145105271) has the molecular formula C9H23NO and a molecular weight of 161.29 g/mol. Its IUPAC name is 2-[di(propan-2-yl)amino]ethanol;methane.

Molecular Properties

Compound Name2-[di(propan-2-yl)amino]ethanol;methane
PubChem CID145105271
Molecular FormulaC9H23NO
Molecular Weight161.29 g/mol
Exact Mass161.18
IUPAC Name2-[di(propan-2-yl)amino]ethanol;methane
SMILESC.CC(C)N(CCO)C(C)C
InChIInChI=1S/C8H19NO.CH4/c1-7(2)9(5-6-10)8(3)4;/h7-8,10H,5-6H2,1-4H3;1H4
InChIKeyMNMQAHCWLDTKGU-UHFFFAOYSA-N
XLogP1.73
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.29
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(diethylamino)propan-1-ol;2-(dimethylamino)ethanol;3-(dimethylamino)propan-1-ol;2-[di(propan-2-yl)amino]ethanol
CID 174850571
2-[di(propan-2-yl)amino]ethanol;2-[(2-hydroxycyclohexyl)-methylamino]cyclohexan-1-ol
CID 138617266
2-[butan-2-yl(pentan-3-yl)amino]ethanol
CID 62016641
2-[methanidyl(propan-2-yl)amino]ethanol
CID 59626620
N-cyclopropyl-N-propan-2-ylcyclopropanamine;N,N-diethylpropan-2-amine;2-[di(propan-2-yl)amino]ethanol;N-ethyl-N-propan-2-ylpropan-2-amine
CID 160556177
1-[2-[di(propan-2-yl)amino]ethyl]-3-(2-hydroxyethyl)urea
CID 110894307
5-[2-[di(propan-2-yl)amino]ethylamino]pentan-1-ol
CID 62228638
N-[2-[di(propan-2-yl)amino]ethyl]-N,N',N'-tri(propan-2-yl)ethane-1,2-diamine
CID 59309380
2-[[2-amino-1-(4-methylphenyl)propyl]-propan-2-ylamino]ethanol
CID 55016801
2-[2-hydroxyethyl(propan-2-yl)amino]-2-phenylacetic acid
CID 54994766
2-[tert-butyl(propan-2-yl)amino]ethanol
CID 54545866
N,N-di(propan-2-yl)butan-1-amine
CID 11062646

Frequently Asked Questions

What is the IUPAC name of 2-[di(propan-2-yl)amino]ethanol;methane?
The IUPAC name of 2-[di(propan-2-yl)amino]ethanol;methane (CID 145105271) is 2-[di(propan-2-yl)amino]ethanol;methane.
What is the SMILES notation for 2-[di(propan-2-yl)amino]ethanol;methane?
The canonical SMILES for 2-[di(propan-2-yl)amino]ethanol;methane is C.CC(C)N(CCO)C(C)C.
What is the InChIKey of 2-[di(propan-2-yl)amino]ethanol;methane?
The InChIKey is MNMQAHCWLDTKGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO.CH4/c1-7(2)9(5-6-10)8(3)4;/h7-8,10H,5-6H2,1-4H3;1H4.
What are the key properties of 2-[di(propan-2-yl)amino]ethanol;methane?
2-[di(propan-2-yl)amino]ethanol;methane has a molecular weight of 161.29 g/mol, XLogP of 1.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[di(propan-2-yl)amino]ethanol;methane is sourced from PubChem (CID 145105271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).