ethane;2-[(1-ethylcyclopropyl)amino]ethanol

C9H21NO — CID 177193430

IUPACethane;2-[(1-ethylcyclopropyl)amino]ethanol
SMILESCC.CCC1(NCCO)CC1
InChIInChI=1S/C7H15NO.C2H6/c1-2-7(3-4-7)8-5-6-9;1-2/h8-9H,2-6H2,1H3;1-2H3
InChIKeyHFRDILGIUGRSLU-UHFFFAOYSA-N
MW159.27 g/mol
LogP1.54
Rot. Bonds4

About ethane;2-[(1-ethylcyclopropyl)amino]ethanol

ethane;2-[(1-ethylcyclopropyl)amino]ethanol (PubChem CID 177193430) has the molecular formula C9H21NO and a molecular weight of 159.27 g/mol. Its IUPAC name is ethane;2-[(1-ethylcyclopropyl)amino]ethanol.

Molecular Properties

Compound Nameethane;2-[(1-ethylcyclopropyl)amino]ethanol
PubChem CID177193430
Molecular FormulaC9H21NO
Molecular Weight159.27 g/mol
Exact Mass159.16
IUPAC Nameethane;2-[(1-ethylcyclopropyl)amino]ethanol
SMILESCC.CCC1(NCCO)CC1
InChIInChI=1S/C7H15NO.C2H6/c1-2-7(3-4-7)8-5-6-9;1-2/h8-9H,2-6H2,1H3;1-2H3
InChIKeyHFRDILGIUGRSLU-UHFFFAOYSA-N
XLogP1.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.27
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 107703649
2-[[3-(aminomethyl)oxolan-3-yl]amino]ethanol;ethane
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2-(2-hydroxyethylamino)ethanol;propane
CID 142274456
N-butyl-1-ethylcyclohexan-1-amine
CID 163975014
2-[(1-prop-2-enylcyclohexyl)amino]ethanol
CID 2818347
[8-(propylamino)spiro[4.5]decan-8-yl]methanol
CID 114819876
2-[[4-(aminomethyl)-1,1-dioxothian-4-yl]amino]ethanol
CID 65382561
N-(1-ethylcyclopropyl)acetamide
CID 67691252
ethane;2-[2-(ethylamino)ethylamino]ethanol
CID 156647808
1-ethyl-N-(2-ethylsulfanylethyl)cyclobutan-1-amine
CID 104668682
2-[[1-(aminomethyl)-3-methoxycyclobutyl]amino]ethanol
CID 106822123
(2S)-3-[(1-ethylcyclobutyl)amino]propane-1,2-diol
CID 104866229

Frequently Asked Questions

What is the IUPAC name of ethane;2-[(1-ethylcyclopropyl)amino]ethanol?
The IUPAC name of ethane;2-[(1-ethylcyclopropyl)amino]ethanol (CID 177193430) is ethane;2-[(1-ethylcyclopropyl)amino]ethanol.
What is the SMILES notation for ethane;2-[(1-ethylcyclopropyl)amino]ethanol?
The canonical SMILES for ethane;2-[(1-ethylcyclopropyl)amino]ethanol is CC.CCC1(NCCO)CC1.
What is the InChIKey of ethane;2-[(1-ethylcyclopropyl)amino]ethanol?
The InChIKey is HFRDILGIUGRSLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.C2H6/c1-2-7(3-4-7)8-5-6-9;1-2/h8-9H,2-6H2,1H3;1-2H3.
What are the key properties of ethane;2-[(1-ethylcyclopropyl)amino]ethanol?
ethane;2-[(1-ethylcyclopropyl)amino]ethanol has a molecular weight of 159.27 g/mol, XLogP of 1.54, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-[(1-ethylcyclopropyl)amino]ethanol is sourced from PubChem (CID 177193430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).