1-amino-2-ethylcyclopropan-1-ol

C5H11NO — CID 163837248

IUPAC1-amino-2-ethylcyclopropan-1-ol
SMILESCCC1CC1(N)O
InChIInChI=1S/C5H11NO/c1-2-4-3-5(4,6)7/h4,7H,2-3,6H2,1H3
InChIKeyOIVDUDDLYCSSCG-UHFFFAOYSA-N
MW101.15 g/mol
LogP0.06
Rot. Bonds1

About 1-amino-2-ethylcyclopropan-1-ol

1-amino-2-ethylcyclopropan-1-ol (PubChem CID 163837248) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is 1-amino-2-ethylcyclopropan-1-ol.

Molecular Properties

Compound Name1-amino-2-ethylcyclopropan-1-ol
PubChem CID163837248
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name1-amino-2-ethylcyclopropan-1-ol
SMILESCCC1CC1(N)O
InChIInChI=1S/C5H11NO/c1-2-4-3-5(4,6)7/h4,7H,2-3,6H2,1H3
InChIKeyOIVDUDDLYCSSCG-UHFFFAOYSA-N
XLogP0.06
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-[(1S)-1-amino-2-ethylcyclopropyl]acetic acid
CID 55288762
2-(1-amino-2-ethylcyclopropyl)phenol
CID 84656088
cis-(1S,2S)-1-amino-2-ethylcyclopropane-1-carbonitrile
CID 11768533
cis-(1R,2S)-1-(2-chloroethyl)-2-ethylcyclopropan-1-ol
CID 15528876
(2R)-2-ethyl-1,1-difluorocyclopropane
CID 123881327
benzyl 1-amino-2-ethylcyclopropane-1-carboxylate
CID 73121008
1-butan-2-yl-2-ethylcyclopropan-1-amine
CID 79332461
1-(cyclopropylmethyl)-2-ethylcyclopropan-1-ol
CID 79333627
2-ethyl-1-(3-ethylthiophen-2-yl)cyclopropan-1-ol
CID 79333969
1-[(1R,2R)-1-amino-2-ethylcyclopropyl]-2-methylprop-2-en-1-one
CID 89079632
(2S)-2-amino-2-[(1R,2R)-1-amino-2-ethylcyclopropyl]acetic acid
CID 11768839
trans-(1R,2S)-1,2-diethylcyclohexan-1-ol
CID 86308413

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-ethylcyclopropan-1-ol?
The IUPAC name of 1-amino-2-ethylcyclopropan-1-ol (CID 163837248) is 1-amino-2-ethylcyclopropan-1-ol.
What is the SMILES notation for 1-amino-2-ethylcyclopropan-1-ol?
The canonical SMILES for 1-amino-2-ethylcyclopropan-1-ol is CCC1CC1(N)O.
What is the InChIKey of 1-amino-2-ethylcyclopropan-1-ol?
The InChIKey is OIVDUDDLYCSSCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO/c1-2-4-3-5(4,6)7/h4,7H,2-3,6H2,1H3.
What are the key properties of 1-amino-2-ethylcyclopropan-1-ol?
1-amino-2-ethylcyclopropan-1-ol has a molecular weight of 101.15 g/mol, XLogP of 0.06, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-ethylcyclopropan-1-ol is sourced from PubChem (CID 163837248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).