4-ethyl-3-(furan-2-yl)-N-methylcyclohexan-1-amine

C13H21NO — CID 165491970

IUPAC4-ethyl-3-(furan-2-yl)-N-methylcyclohexan-1-amine
SMILESCCC1CCC(NC)CC1c1ccco1
InChIInChI=1S/C13H21NO/c1-3-10-6-7-11(14-2)9-12(10)13-5-4-8-15-13/h4-5,8,10-12,14H,3,6-7,9H2,1-2H3
InChIKeyDWYHBJQIVYZPLR-UHFFFAOYSA-N
MW207.32 g/mol
LogP3.16
Rot. Bonds3

About 4-ethyl-3-(furan-2-yl)-N-methylcyclohexan-1-amine

4-ethyl-3-(furan-2-yl)-N-methylcyclohexan-1-amine (PubChem CID 165491970) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is 4-ethyl-3-(furan-2-yl)-N-methylcyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-3-(furan-2-yl)-N-methylcyclohexan-1-amine
PubChem CID165491970
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Name4-ethyl-3-(furan-2-yl)-N-methylcyclohexan-1-amine
SMILESCCC1CCC(NC)CC1c1ccco1
InChIInChI=1S/C13H21NO/c1-3-10-6-7-11(14-2)9-12(10)13-5-4-8-15-13/h4-5,8,10-12,14H,3,6-7,9H2,1-2H3
InChIKeyDWYHBJQIVYZPLR-UHFFFAOYSA-N
XLogP3.16
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-ethyl-2-(furan-2-yl)cyclohexyl]-N-methylmethanamine
CID 81031398
2-(furan-2-yl)-N-methylcyclopentan-1-amine
CID 63950398
3-(furan-2-yl)-N,4,4-trimethylcyclohexan-1-amine
CID 165498088
N-[[(1R,2R)-2-(furan-2-yl)cyclopropyl]methyl]-N-hydroxyacetamide
CID 22844507
N-[[2-(furan-2-yl)cyclopropyl]methyl]-N-hydroxyacetamide
CID 19894128
2-(4-propylcyclohexyl)furan
CID 174853183
cyclopropyl-[2-(furan-2-yl)cyclopropyl]methanone
CID 549488
[2-(furan-2-yl)cycloheptyl]methanamine
CID 81010401
2-(furan-2-yl)cyclobutane-1-carboxylic acid
CID 81009452
(1S)-1-[(1R,2S)-2-(furan-2-yl)cyclopropyl]ethanamine
CID 29079255
cis-(1R,2S)-2-(furan-2-yl)cyclohexan-1-ol
CID 95256771
[(3S,4S)-4-(furan-2-yl)-1-methylpyrrolidin-3-yl]methanamine
CID 96744208

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-(furan-2-yl)-N-methylcyclohexan-1-amine?
The IUPAC name of 4-ethyl-3-(furan-2-yl)-N-methylcyclohexan-1-amine (CID 165491970) is 4-ethyl-3-(furan-2-yl)-N-methylcyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-3-(furan-2-yl)-N-methylcyclohexan-1-amine?
The canonical SMILES for 4-ethyl-3-(furan-2-yl)-N-methylcyclohexan-1-amine is CCC1CCC(NC)CC1c1ccco1.
What is the InChIKey of 4-ethyl-3-(furan-2-yl)-N-methylcyclohexan-1-amine?
The InChIKey is DWYHBJQIVYZPLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c1-3-10-6-7-11(14-2)9-12(10)13-5-4-8-15-13/h4-5,8,10-12,14H,3,6-7,9H2,1-2H3.
What are the key properties of 4-ethyl-3-(furan-2-yl)-N-methylcyclohexan-1-amine?
4-ethyl-3-(furan-2-yl)-N-methylcyclohexan-1-amine has a molecular weight of 207.32 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-(furan-2-yl)-N-methylcyclohexan-1-amine is sourced from PubChem (CID 165491970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).