2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol

C14H29NO2 — CID 64751103

IUPAC2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol
SMILESCCOCCN(CC)C1C(C)CC(C)CC1O
InChIInChI=1S/C14H29NO2/c1-5-15(7-8-17-6-2)14-12(4)9-11(3)10-13(14)16/h11-14,16H,5-10H2,1-4H3
InChIKeySFSZVYFFCJHQGD-UHFFFAOYSA-N
MW243.39 g/mol
LogP2.14
Rot. Bonds6

About 2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol

2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol (PubChem CID 64751103) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol.

Molecular Properties

Compound Name2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol
PubChem CID64751103
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol
SMILESCCOCCN(CC)C1C(C)CC(C)CC1O
InChIInChI=1S/C14H29NO2/c1-5-15(7-8-17-6-2)14-12(4)9-11(3)10-13(14)16/h11-14,16H,5-10H2,1-4H3
InChIKeySFSZVYFFCJHQGD-UHFFFAOYSA-N
XLogP2.14
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol?
The IUPAC name of 2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol (CID 64751103) is 2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol.
What is the SMILES notation for 2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol?
The canonical SMILES for 2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol is CCOCCN(CC)C1C(C)CC(C)CC1O.
What is the InChIKey of 2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol?
The InChIKey is SFSZVYFFCJHQGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-5-15(7-8-17-6-2)14-12(4)9-11(3)10-13(14)16/h11-14,16H,5-10H2,1-4H3.
What are the key properties of 2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol?
2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol has a molecular weight of 243.39 g/mol, XLogP of 2.14, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol is sourced from PubChem (CID 64751103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).