1-(cyclohexen-1-yl)-N-methyl-1-(2-methyloxan-2-yl)methanamine

C14H25NO — CID 106654056

IUPAC1-(cyclohexen-1-yl)-N-methyl-1-(2-methyloxan-2-yl)methanamine
SMILESCNC(C1=CCCCC1)C1(C)CCCCO1
InChIInChI=1S/C14H25NO/c1-14(10-6-7-11-16-14)13(15-2)12-8-4-3-5-9-12/h8,13,15H,3-7,9-11H2,1-2H3
InChIKeyUFXBCZGVIKABPM-UHFFFAOYSA-N
MW223.36 g/mol
LogP3.03
Rot. Bonds3

About 1-(cyclohexen-1-yl)-N-methyl-1-(2-methyloxan-2-yl)methanamine

1-(cyclohexen-1-yl)-N-methyl-1-(2-methyloxan-2-yl)methanamine (PubChem CID 106654056) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 1-(cyclohexen-1-yl)-N-methyl-1-(2-methyloxan-2-yl)methanamine.

Molecular Properties

Compound Name1-(cyclohexen-1-yl)-N-methyl-1-(2-methyloxan-2-yl)methanamine
PubChem CID106654056
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name1-(cyclohexen-1-yl)-N-methyl-1-(2-methyloxan-2-yl)methanamine
SMILESCNC(C1=CCCCC1)C1(C)CCCCO1
InChIInChI=1S/C14H25NO/c1-14(10-6-7-11-16-14)13(15-2)12-8-4-3-5-9-12/h8,13,15H,3-7,9-11H2,1-2H3
InChIKeyUFXBCZGVIKABPM-UHFFFAOYSA-N
XLogP3.03
TPSA21.26 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 ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[2-(Cyclohexen-1-yl)-2-fluoropropyl]morpholine
CID 106655073
3,3-Di(cyclohexen-1-yl)morpholine
CID 57287098
(4R)-spiro[2-azabicyclo[2.2.2]oct-5-ene-7,2'-oxane]
CID 89721823
N-[cyclohexen-1-yl(oxan-2-yl)methyl]propan-1-amine
CID 55048190
N-[cyclohexen-1-yl(oxan-4-yl)methyl]propan-1-amine
CID 55133142
1-(cyclohexen-1-yl)-N-methyl-1-(oxan-2-yl)methanamine
CID 62212633
N-[cyclohexen-1-yl(oxan-2-yl)methyl]ethanamine
CID 62212634
1-(cyclopenten-1-yl)-N-methyl-1-(oxan-2-yl)methanamine
CID 62212813
N-[cyclopenten-1-yl(oxan-2-yl)methyl]ethanamine
CID 62212814
N-[cyclopenten-1-yl(oxan-2-yl)methyl]propan-1-amine
CID 62212991
1-(cyclohexen-1-yl)-N-methyl-1-(oxan-4-yl)methanamine
CID 62907584
N-[cyclohexen-1-yl(oxan-4-yl)methyl]ethanamine
CID 62907585

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexen-1-yl)-N-methyl-1-(2-methyloxan-2-yl)methanamine?
The IUPAC name of 1-(cyclohexen-1-yl)-N-methyl-1-(2-methyloxan-2-yl)methanamine (CID 106654056) is 1-(cyclohexen-1-yl)-N-methyl-1-(2-methyloxan-2-yl)methanamine.
What is the SMILES notation for 1-(cyclohexen-1-yl)-N-methyl-1-(2-methyloxan-2-yl)methanamine?
The canonical SMILES for 1-(cyclohexen-1-yl)-N-methyl-1-(2-methyloxan-2-yl)methanamine is CNC(C1=CCCCC1)C1(C)CCCCO1.
What is the InChIKey of 1-(cyclohexen-1-yl)-N-methyl-1-(2-methyloxan-2-yl)methanamine?
The InChIKey is UFXBCZGVIKABPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-14(10-6-7-11-16-14)13(15-2)12-8-4-3-5-9-12/h8,13,15H,3-7,9-11H2,1-2H3.
What are the key properties of 1-(cyclohexen-1-yl)-N-methyl-1-(2-methyloxan-2-yl)methanamine?
1-(cyclohexen-1-yl)-N-methyl-1-(2-methyloxan-2-yl)methanamine has a molecular weight of 223.36 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexen-1-yl)-N-methyl-1-(2-methyloxan-2-yl)methanamine is sourced from PubChem (CID 106654056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).