[2-(ethylamino)cyclohepten-1-yl]methanol

C10H19NO — CID 143063220

IUPAC[2-(ethylamino)cyclohepten-1-yl]methanol
SMILESCCNC1=C(CO)CCCCC1
InChIInChI=1S/C10H19NO/c1-2-11-10-7-5-3-4-6-9(10)8-12/h11-12H,2-8H2,1H3
InChIKeyJTDOXZDHOVMYFV-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.81
Rot. Bonds3

About [2-(ethylamino)cyclohepten-1-yl]methanol

[2-(ethylamino)cyclohepten-1-yl]methanol (PubChem CID 143063220) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is [2-(ethylamino)cyclohepten-1-yl]methanol.

Molecular Properties

Compound Name[2-(ethylamino)cyclohepten-1-yl]methanol
PubChem CID143063220
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name[2-(ethylamino)cyclohepten-1-yl]methanol
SMILESCCNC1=C(CO)CCCCC1
InChIInChI=1S/C10H19NO/c1-2-11-10-7-5-3-4-6-9(10)8-12/h11-12H,2-8H2,1H3
InChIKeyJTDOXZDHOVMYFV-UHFFFAOYSA-N
XLogP1.81
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Ethane;[2-(ethylamino)cyclohepten-1-yl]methanol
CID 143063219
[(4R)-4-(ethylamino)cyclohepten-1-yl]methanol
CID 166839766
9-(1-Cyclobutylideneethylamino)nonan-1-ol
CID 174195445
1-(Cyclohepten-1-yl)-2-(ethylamino)ethanol
CID 106654883
1-(Cyclohepten-1-yl)-2-(propylamino)ethanol
CID 106654886
1-(Cyclohepten-1-yl)-2-(propan-2-ylamino)ethanol
CID 106654889
2-(Tert-butylamino)-1-(cyclohepten-1-yl)ethanol
CID 106654895

Frequently Asked Questions

What is the IUPAC name of [2-(ethylamino)cyclohepten-1-yl]methanol?
The IUPAC name of [2-(ethylamino)cyclohepten-1-yl]methanol (CID 143063220) is [2-(ethylamino)cyclohepten-1-yl]methanol.
What is the SMILES notation for [2-(ethylamino)cyclohepten-1-yl]methanol?
The canonical SMILES for [2-(ethylamino)cyclohepten-1-yl]methanol is CCNC1=C(CO)CCCCC1.
What is the InChIKey of [2-(ethylamino)cyclohepten-1-yl]methanol?
The InChIKey is JTDOXZDHOVMYFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-2-11-10-7-5-3-4-6-9(10)8-12/h11-12H,2-8H2,1H3.
What are the key properties of [2-(ethylamino)cyclohepten-1-yl]methanol?
[2-(ethylamino)cyclohepten-1-yl]methanol has a molecular weight of 169.27 g/mol, XLogP of 1.81, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(ethylamino)cyclohepten-1-yl]methanol is sourced from PubChem (CID 143063220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).