1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine

C14H26N2O — CID 102651855

IUPAC1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine
SMILESCNC(C1=CCCO1)C1(N(C)C)CCCCC1
InChIInChI=1S/C14H26N2O/c1-15-13(12-8-7-11-17-12)14(16(2)3)9-5-4-6-10-14/h8,13,15H,4-7,9-11H2,1-3H3
InChIKeyATJHGSOPYLPTLX-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.14
Rot. Bonds4

About 1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine

1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine (PubChem CID 102651855) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine
PubChem CID102651855
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine
SMILESCNC(C1=CCCO1)C1(N(C)C)CCCCC1
InChIInChI=1S/C14H26N2O/c1-15-13(12-8-7-11-17-12)14(16(2)3)9-5-4-6-10-14/h8,13,15H,4-7,9-11H2,1-3H3
InChIKeyATJHGSOPYLPTLX-UHFFFAOYSA-N
XLogP2.14
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2,3-dihydrofuran-5-yl(ethylamino)methyl]-N,N-dimethylcycloheptan-1-amine
CID 102651868
1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-dimethylcyclohexan-1-amine
CID 102651857
1-[3,4-dihydro-2H-pyran-6-yl(methylamino)methyl]-N,N,4-trimethylcyclohexan-1-amine
CID 102647752
1-[3,4-dihydro-2H-pyran-6-yl(propylamino)methyl]-N,N-dimethylcyclohexan-1-amine
CID 102647750
1-[2,3-dihydrofuran-5-yl(propylamino)methyl]-N,N-diethylcyclopentan-1-amine
CID 102651843
1-(3,4-dihydro-2H-pyran-6-yl)-1-(1-ethoxycyclopentyl)-N-methylmethanamine
CID 102648107
N,N-dimethyl-1-[methylamino-(5-methylthiophen-2-yl)methyl]cyclohexan-1-amine
CID 79066072
1-[amino(2,3-dihydrofuran-5-yl)methyl]-N,N,3-trimethylcyclohexan-1-amine
CID 102651862
1-cyclohexyl-1-(2,3-dihydrofuran-5-yl)-N-methylmethanamine
CID 102651300
1-[3,4-dihydro-2H-pyran-6-yl(ethylamino)methyl]-N,N,3-trimethylcyclohexan-1-amine
CID 102647756
N,N-dimethyl-1-[methylamino-(2-methylpyrazol-3-yl)methyl]cycloheptan-1-amine
CID 79080561
N,N-dimethyl-1-[methylamino-(2-methylphenyl)methyl]cyclohexan-1-amine
CID 79066063

Frequently Asked Questions

What is the IUPAC name of 1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine?
The IUPAC name of 1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine (CID 102651855) is 1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine.
What is the SMILES notation for 1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine?
The canonical SMILES for 1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine is CNC(C1=CCCO1)C1(N(C)C)CCCCC1.
What is the InChIKey of 1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine?
The InChIKey is ATJHGSOPYLPTLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-15-13(12-8-7-11-17-12)14(16(2)3)9-5-4-6-10-14/h8,13,15H,4-7,9-11H2,1-3H3.
What are the key properties of 1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine?
1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine has a molecular weight of 238.37 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2,3-dihydrofuran-5-yl(methylamino)methyl]-N,N-dimethylcyclohexan-1-amine is sourced from PubChem (CID 102651855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).