2-N-ethyl-2-N-methylcyclododecane-1,2-diamine

C15H32N2 — CID 43263336

IUPAC2-N-ethyl-2-N-methylcyclododecane-1,2-diamine
SMILESCCN(C)C1CCCCCCCCCCC1N
InChIInChI=1S/C15H32N2/c1-3-17(2)15-13-11-9-7-5-4-6-8-10-12-14(15)16/h14-15H,3-13,16H2,1-2H3
InChIKeyYRTIGCBOWFIZJT-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.55
Rot. Bonds2

About 2-N-ethyl-2-N-methylcyclododecane-1,2-diamine

2-N-ethyl-2-N-methylcyclododecane-1,2-diamine (PubChem CID 43263336) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is 2-N-ethyl-2-N-methylcyclododecane-1,2-diamine.

Molecular Properties

Compound Name2-N-ethyl-2-N-methylcyclododecane-1,2-diamine
PubChem CID43263336
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC Name2-N-ethyl-2-N-methylcyclododecane-1,2-diamine
SMILESCCN(C)C1CCCCCCCCCCC1N
InChIInChI=1S/C15H32N2/c1-3-17(2)15-13-11-9-7-5-4-6-8-10-12-14(15)16/h14-15H,3-13,16H2,1-2H3
InChIKeyYRTIGCBOWFIZJT-UHFFFAOYSA-N
XLogP3.55
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-N-methyl-2-N-(2-methylbutyl)cyclododecane-1,2-diamine
CID 43295671
1-N-cyclopentyl-1-N-ethylcycloheptane-1,2-diamine
CID 43541082
2-N-(2-methoxyethyl)-2-N-methylcyclooctane-1,2-diamine
CID 61427471
1-N-butyl-1-N-methylcyclopentane-1,2-diamine
CID 43184025
2-N-cyclopentyl-2-N-ethylcyclohexane-1,2-diamine
CID 43541047
2-N-(3-methoxypropyl)-2-N-methylcyclododecane-1,2-diamine
CID 63468227
2-N-methyl-2-N-(2-methylsulfanylethyl)cyclohexane-1,2-diamine
CID 112663651
trans-(1S,2S)-2-N,2-N-dimethylcyclohexane-1,2-diamine;dihydrochloride
CID 46941649
2-N-methyl-2-N-(2-propan-2-yloxyethyl)cyclooctane-1,2-diamine
CID 81056474
2-N-methyl-2-N-(oxan-2-ylmethyl)cyclooctane-1,2-diamine
CID 61431779
2-[[methyl-(2-methylcyclohexyl)amino]methyl]cycloheptan-1-amine
CID 62609656
2-N-ethyl-2-N-(2-methylpropyl)cyclooctane-1,2-diamine
CID 43273695

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-2-N-methylcyclododecane-1,2-diamine?
The IUPAC name of 2-N-ethyl-2-N-methylcyclododecane-1,2-diamine (CID 43263336) is 2-N-ethyl-2-N-methylcyclododecane-1,2-diamine.
What is the SMILES notation for 2-N-ethyl-2-N-methylcyclododecane-1,2-diamine?
The canonical SMILES for 2-N-ethyl-2-N-methylcyclododecane-1,2-diamine is CCN(C)C1CCCCCCCCCCC1N.
What is the InChIKey of 2-N-ethyl-2-N-methylcyclododecane-1,2-diamine?
The InChIKey is YRTIGCBOWFIZJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-3-17(2)15-13-11-9-7-5-4-6-8-10-12-14(15)16/h14-15H,3-13,16H2,1-2H3.
What are the key properties of 2-N-ethyl-2-N-methylcyclododecane-1,2-diamine?
2-N-ethyl-2-N-methylcyclododecane-1,2-diamine has a molecular weight of 240.43 g/mol, XLogP of 3.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-2-N-methylcyclododecane-1,2-diamine is sourced from PubChem (CID 43263336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).