N-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine

C15H30N2O — CID 82734580

IUPACN-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine
SMILESCC1CCC(C(CN)N(C)C2CCOC2C)CC1
InChIInChI=1S/C15H30N2O/c1-11-4-6-13(7-5-11)15(10-16)17(3)14-8-9-18-12(14)2/h11-15H,4-10,16H2,1-3H3
InChIKeyMGCYUICTEWMYOD-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.25
Rot. Bonds4

About N-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine

N-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine (PubChem CID 82734580) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine
PubChem CID82734580
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine
SMILESCC1CCC(C(CN)N(C)C2CCOC2C)CC1
InChIInChI=1S/C15H30N2O/c1-11-4-6-13(7-5-11)15(10-16)17(3)14-8-9-18-12(14)2/h11-15H,4-10,16H2,1-3H3
InChIKeyMGCYUICTEWMYOD-UHFFFAOYSA-N
XLogP2.25
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine with MolForge

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Related Compounds

1-cyclopropyl-N-methyl-N-(4-methylcycloheptyl)ethane-1,2-diamine
CID 116651214
N-methyl-N-(2-methyloxolan-3-yl)-1-(4-propan-2-ylphenyl)ethane-1,2-diamine
CID 82734785
2-[methyl-(2-methyloxolan-3-yl)amino]propanenitrile
CID 82738997
N-[1-(aminomethyl)-3-methylcyclobutyl]-N,2-dimethyloxolan-3-amine
CID 103563096
2-N-methyl-2-N-(2-methyloxolan-3-yl)pentane-2,3-diamine
CID 82734283
ethyl 2-[methyl-(2-methyloxolan-3-yl)amino]pentanoate
CID 83049005
N-cyclopropyl-N-methyl-1-(oxan-4-yl)ethane-1,2-diamine
CID 62384670
1-cyclopropyl-N-(2,2-dimethyloxan-4-yl)-N-methylethane-1,2-diamine
CID 116651576
N'-methyl-N'-(2-methyloxolan-3-yl)-2-phenylpropane-1,3-diamine
CID 82733792
5-methoxy-4-N-methyl-4-N-(2-methyloxolan-3-yl)pentane-1,4-diamine
CID 103391992
1-N,3-N-dimethyl-3-N-(2-methyloxolan-3-yl)butane-1,3-diamine
CID 82753901
N-methyl-1-(4-methylcyclohexyl)-N-(1-methylsulfanylpropan-2-yl)ethane-1,2-diamine
CID 112658601

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine?
The IUPAC name of N-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine (CID 82734580) is N-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine.
What is the SMILES notation for N-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine?
The canonical SMILES for N-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine is CC1CCC(C(CN)N(C)C2CCOC2C)CC1.
What is the InChIKey of N-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine?
The InChIKey is MGCYUICTEWMYOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-11-4-6-13(7-5-11)15(10-16)17(3)14-8-9-18-12(14)2/h11-15H,4-10,16H2,1-3H3.
What are the key properties of N-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine?
N-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine has a molecular weight of 254.42 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-methylcyclohexyl)-N-(2-methyloxolan-3-yl)ethane-1,2-diamine is sourced from PubChem (CID 82734580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).