N-methyl-N-(2-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine

C15H30N2O — CID 82836612

IUPACN-methyl-N-(2-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine
SMILESCC1CCC(C(CN)N(C)C2CCCCC2C)O1
InChIInChI=1S/C15H30N2O/c1-11-6-4-5-7-13(11)17(3)14(10-16)15-9-8-12(2)18-15/h11-15H,4-10,16H2,1-3H3
InChIKeyUXEJCZPEYDJPBZ-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.39
Rot. Bonds4

About N-methyl-N-(2-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine

N-methyl-N-(2-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine (PubChem CID 82836612) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-methyl-N-(2-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-methyl-N-(2-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine
PubChem CID82836612
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-methyl-N-(2-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine
SMILESCC1CCC(C(CN)N(C)C2CCCCC2C)O1
InChIInChI=1S/C15H30N2O/c1-11-6-4-5-7-13(11)17(3)14(10-16)15-9-8-12(2)18-15/h11-15H,4-10,16H2,1-3H3
InChIKeyUXEJCZPEYDJPBZ-UHFFFAOYSA-N
XLogP2.39
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 ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-N-methyl-1-(5-methyloxolan-2-yl)ethane-1,2-diamine
CID 82835693
N-methyl-N-(3-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine
CID 82836610
N-(cyclohexylmethyl)-N-methyl-1-(5-methyloxolan-2-yl)ethane-1,2-diamine
CID 82836511
N-methyl-N-(2-methylcyclohexyl)-1-(thiolan-3-yl)ethane-1,2-diamine
CID 107132681
N-cyclopropyl-N-(cyclopropylmethyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine
CID 82835825
N,N-bis(2-methoxyethyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine
CID 82835200
N-(2-fluorophenyl)-N-methyl-1-(5-methyloxolan-2-yl)ethane-1,2-diamine
CID 82836219
N-cyclopentyl-1-(5-methyloxolan-2-yl)ethane-1,2-diamine
CID 82836031
N-methyl-1-(5-methyloxolan-2-yl)-N-(2-pyridin-4-ylethyl)ethane-1,2-diamine
CID 82835297
N-[(4-bromothiophen-2-yl)methyl]-N-methyl-1-(5-methyloxolan-2-yl)ethane-1,2-diamine
CID 82835107
N-butan-2-yl-N-(2-methoxyethyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine
CID 82836012
N-methyl-N-(2-methylcyclohexyl)-1-(4-methylphenyl)ethane-1,2-diamine
CID 55005212

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine?
The IUPAC name of N-methyl-N-(2-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine (CID 82836612) is N-methyl-N-(2-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine.
What is the SMILES notation for N-methyl-N-(2-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine?
The canonical SMILES for N-methyl-N-(2-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine is CC1CCC(C(CN)N(C)C2CCCCC2C)O1.
What is the InChIKey of N-methyl-N-(2-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine?
The InChIKey is UXEJCZPEYDJPBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-11-6-4-5-7-13(11)17(3)14(10-16)15-9-8-12(2)18-15/h11-15H,4-10,16H2,1-3H3.
What are the key properties of N-methyl-N-(2-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine?
N-methyl-N-(2-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine has a molecular weight of 254.42 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylcyclohexyl)-1-(5-methyloxolan-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 82836612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).