3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine

C14H25NO — CID 102647598

IUPAC3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine
SMILESCCC1CCCC(C(N)C2=CCCCO2)C1
InChIInChI=1S/C14H25NO/c1-2-11-6-5-7-12(10-11)14(15)13-8-3-4-9-16-13/h8,11-12,14H,2-7,9-10,15H2,1H3
InChIKeyFLRCPRWMDNTYQL-UHFFFAOYSA-N
MW223.36 g/mol
LogP3.22
Rot. Bonds3

About 3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine

3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine (PubChem CID 102647598) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine.

Molecular Properties

Compound Name3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine
PubChem CID102647598
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine
SMILESCCC1CCCC(C(N)C2=CCCCO2)C1
InChIInChI=1S/C14H25NO/c1-2-11-6-5-7-12(10-11)14(15)13-8-3-4-9-16-13/h8,11-12,14H,2-7,9-10,15H2,1H3
InChIKeyFLRCPRWMDNTYQL-UHFFFAOYSA-N
XLogP3.22
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3,4-dihydro-2H-pyran-6-yl-[3-(trifluoromethyl)cyclohexyl]methyl]propan-1-amine
CID 102648859
(4,4-difluorocyclohexyl)-(3,4-dihydro-2H-pyran-6-yl)methanamine
CID 102649150
1-(3,4-dihydro-2H-pyran-6-yl)-N-methyl-1-[3-(trifluoromethyl)cyclohexyl]methanamine
CID 102649388
3,4-dihydro-2H-pyran-6-yl-[2-(trifluoromethyl)cyclohexyl]methanamine
CID 102649495
N-[3,4-dihydro-2H-pyran-6-yl-[3-(trifluoromethyl)cyclohexyl]methyl]ethanamine
CID 102649626
2,3-Dihydrofuran-5-yl-[3-(trifluoromethyl)cyclohexyl]methanamine
CID 102653077
2,3-Dihydrofuran-5-yl-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 102653422
3,4-dihydro-2H-pyran-6-yl-[3-(trifluoromethyl)cyclohexyl]methanamine
CID 113720519
3,4-dihydro-2H-pyran-6-yl-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 113720576
2-Butan-2-yloxy-1-cyclohexylprop-2-en-1-amine
CID 90874517
3-(1-Oxaspiro[5.5]undecan-4-yl)cyclopent-2-en-1-amine
CID 79924117
cyclohexyl(3,4-dihydro-2H-pyran-6-yl)methanamine
CID 102647140

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine?
The IUPAC name of 3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine (CID 102647598) is 3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine.
What is the SMILES notation for 3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine?
The canonical SMILES for 3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine is CCC1CCCC(C(N)C2=CCCCO2)C1.
What is the InChIKey of 3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine?
The InChIKey is FLRCPRWMDNTYQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-2-11-6-5-7-12(10-11)14(15)13-8-3-4-9-16-13/h8,11-12,14H,2-7,9-10,15H2,1H3.
What are the key properties of 3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine?
3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine has a molecular weight of 223.36 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-pyran-6-yl-(3-ethylcyclohexyl)methanamine is sourced from PubChem (CID 102647598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).