2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine

C15H32N2 — CID 64706595

IUPAC2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine
SMILESCCNC(C)CC(C)N(C)C1CCCCC1C
InChIInChI=1S/C15H32N2/c1-6-16-13(3)11-14(4)17(5)15-10-8-7-9-12(15)2/h12-16H,6-11H2,1-5H3
InChIKeyJYCUGHHBEHNYIR-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.27
Rot. Bonds6

About 2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine

2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine (PubChem CID 64706595) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is 2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine.

Molecular Properties

Compound Name2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine
PubChem CID64706595
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC Name2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine
SMILESCCNC(C)CC(C)N(C)C1CCCCC1C
InChIInChI=1S/C15H32N2/c1-6-16-13(3)11-14(4)17(5)15-10-8-7-9-12(15)2/h12-16H,6-11H2,1-5H3
InChIKeyJYCUGHHBEHNYIR-UHFFFAOYSA-N
XLogP3.27
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine?
The IUPAC name of 2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine (CID 64706595) is 2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine.
What is the SMILES notation for 2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine?
The canonical SMILES for 2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine is CCNC(C)CC(C)N(C)C1CCCCC1C.
What is the InChIKey of 2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine?
The InChIKey is JYCUGHHBEHNYIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-6-16-13(3)11-14(4)17(5)15-10-8-7-9-12(15)2/h12-16H,6-11H2,1-5H3.
What are the key properties of 2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine?
2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine has a molecular weight of 240.43 g/mol, XLogP of 3.27, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-4-N-methyl-4-N-(2-methylcyclohexyl)pentane-2,4-diamine is sourced from PubChem (CID 64706595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).