2-ethyl-N-methoxycyclohexan-1-amine

C9H19NO — CID 64973905

IUPAC2-ethyl-N-methoxycyclohexan-1-amine
SMILESCCC1CCCCC1NOC
InChIInChI=1S/C9H19NO/c1-3-8-6-4-5-7-9(8)10-11-2/h8-10H,3-7H2,1-2H3
InChIKeyMGWPCRVIXJWPMI-UHFFFAOYSA-N
MW157.26 g/mol
LogP2.11
Rot. Bonds3

About 2-ethyl-N-methoxycyclohexan-1-amine

2-ethyl-N-methoxycyclohexan-1-amine (PubChem CID 64973905) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 2-ethyl-N-methoxycyclohexan-1-amine.

Molecular Properties

Compound Name2-ethyl-N-methoxycyclohexan-1-amine
PubChem CID64973905
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name2-ethyl-N-methoxycyclohexan-1-amine
SMILESCCC1CCCCC1NOC
InChIInChI=1S/C9H19NO/c1-3-8-6-4-5-7-9(8)10-11-2/h8-10H,3-7H2,1-2H3
InChIKeyMGWPCRVIXJWPMI-UHFFFAOYSA-N
XLogP2.11
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-methoxycyclohexan-1-amine?
The IUPAC name of 2-ethyl-N-methoxycyclohexan-1-amine (CID 64973905) is 2-ethyl-N-methoxycyclohexan-1-amine.
What is the SMILES notation for 2-ethyl-N-methoxycyclohexan-1-amine?
The canonical SMILES for 2-ethyl-N-methoxycyclohexan-1-amine is CCC1CCCCC1NOC.
What is the InChIKey of 2-ethyl-N-methoxycyclohexan-1-amine?
The InChIKey is MGWPCRVIXJWPMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-3-8-6-4-5-7-9(8)10-11-2/h8-10H,3-7H2,1-2H3.
What are the key properties of 2-ethyl-N-methoxycyclohexan-1-amine?
2-ethyl-N-methoxycyclohexan-1-amine has a molecular weight of 157.26 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-methoxycyclohexan-1-amine is sourced from PubChem (CID 64973905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).