N-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine

C15H27NO — CID 79368658

IUPACN-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1CCOC1C1CC=CCC1
InChIInChI=1S/C15H27NO/c1-15(2,3)16-11-13-9-10-17-14(13)12-7-5-4-6-8-12/h4-5,12-14,16H,6-11H2,1-3H3
InChIKeyTVOPMHQUNBJGFH-UHFFFAOYSA-N
MW237.39 g/mol
LogP3.14
Rot. Bonds3

About N-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine

N-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine (PubChem CID 79368658) has the molecular formula C15H27NO and a molecular weight of 237.39 g/mol. Its IUPAC name is N-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine
PubChem CID79368658
Molecular FormulaC15H27NO
Molecular Weight237.39 g/mol
Exact Mass237.21
IUPAC NameN-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCC1CCOC1C1CC=CCC1
InChIInChI=1S/C15H27NO/c1-15(2,3)16-11-13-9-10-17-14(13)12-7-5-4-6-8-12/h4-5,12-14,16H,6-11H2,1-3H3
InChIKeyTVOPMHQUNBJGFH-UHFFFAOYSA-N
XLogP3.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine 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

2-[(4-Methoxycyclohex-2-en-1-yl)methyl]pyrrolidine
CID 58771865
4-(4-Tert-butylcyclohex-2-en-1-yl)-2,3,3a,4,5,6,7,7a-octahydrofuro[3,2-c]pyridine
CID 129173759
4-[[(3R)-5,5-bis[(9Z,12Z)-octadeca-9,12-dienyl]oxolan-3-yl]methyl]piperidine
CID 155439853
1-(2-bicyclo[2.2.1]hept-5-enyl)-N-[2-(oxolan-2-yl)ethyl]ethanamine
CID 54917118
N-[cyclohexen-1-yl(oxolan-3-yl)methyl]propan-1-amine
CID 62077835
N-[cyclopenten-1-yl(oxolan-3-yl)methyl]ethanamine
CID 62077856
N-[cyclohexen-1-yl(oxolan-3-yl)methyl]ethanamine
CID 62078856
N-[cyclopenten-1-yl(oxolan-3-yl)methyl]propan-1-amine
CID 62079074
1-(cyclohepten-1-yl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 62079085
1-(cyclopenten-1-yl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 62079407
1-(cyclohexen-1-yl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 62080510
N-[cyclopenten-1-yl(oxan-4-yl)methyl]ethanamine
CID 62904966

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine (CID 79368658) is N-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine is CC(C)(C)NCC1CCOC1C1CC=CCC1.
What is the InChIKey of N-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine?
The InChIKey is TVOPMHQUNBJGFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO/c1-15(2,3)16-11-13-9-10-17-14(13)12-7-5-4-6-8-12/h4-5,12-14,16H,6-11H2,1-3H3.
What are the key properties of N-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine?
N-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine has a molecular weight of 237.39 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclohex-3-en-1-yloxolan-3-yl)methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 79368658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).