2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine

C14H32N2 — CID 63945751

IUPAC2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine
SMILESCCCCC(CC)(CN)N(C)C(C)CCC
InChIInChI=1S/C14H32N2/c1-6-9-11-14(8-3,12-15)16(5)13(4)10-7-2/h13H,6-12,15H2,1-5H3
InChIKeySMDGFDARZAQIQV-UHFFFAOYSA-N
MW228.42 g/mol
LogP3.40
Rot. Bonds9

About 2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine

2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine (PubChem CID 63945751) has the molecular formula C14H32N2 and a molecular weight of 228.42 g/mol. Its IUPAC name is 2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine.

Molecular Properties

Compound Name2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine
PubChem CID63945751
Molecular FormulaC14H32N2
Molecular Weight228.42 g/mol
Exact Mass228.26
IUPAC Name2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine
SMILESCCCCC(CC)(CN)N(C)C(C)CCC
InChIInChI=1S/C14H32N2/c1-6-9-11-14(8-3,12-15)16(5)13(4)10-7-2/h13H,6-12,15H2,1-5H3
InChIKeySMDGFDARZAQIQV-UHFFFAOYSA-N
XLogP3.40
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.42
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-N,2-dimethyl-2-N-pentan-2-ylheptane-1,2-diamine
CID 80558210
2-N,2-dimethyl-2-N-pentan-2-yloctane-1,2-diamine
CID 43571908
2-N-(cyclopropylmethyl)-2-ethyl-2-N-methylhexane-1,2-diamine
CID 63947157
2-ethyl-2-N-(3-methoxypropyl)-2-N-methylhexane-1,2-diamine
CID 63951842
2-ethyl-2-N-hexyl-2-N-methylbutane-1,2-diamine
CID 62008988
2-N,2-N-dibutyl-2-ethylpentane-1,2-diamine
CID 114079873
N',2,2-trimethyl-N'-pentan-2-ylpentane-1,5-diamine
CID 65254460
2-ethyl-2-N-methyl-2-N-(2-methyloxolan-3-yl)hexane-1,2-diamine
CID 82734453
2-N-(1-cyclopropylethyl)-2-ethyl-2-N-methylbutane-1,2-diamine
CID 43568950
2-N,2-dimethyl-2-N-pentan-2-yl-3-phenylpropane-1,2-diamine
CID 114992436
2-benzyl-2-N-methyl-2-N-(4-methylpentan-2-yl)butane-1,2-diamine
CID 79008228
2-ethyl-2-N,2-N-bis(3-methylbutyl)butane-1,2-diamine
CID 107869452

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine?
The IUPAC name of 2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine (CID 63945751) is 2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine.
What is the SMILES notation for 2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine?
The canonical SMILES for 2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine is CCCCC(CC)(CN)N(C)C(C)CCC.
What is the InChIKey of 2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine?
The InChIKey is SMDGFDARZAQIQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32N2/c1-6-9-11-14(8-3,12-15)16(5)13(4)10-7-2/h13H,6-12,15H2,1-5H3.
What are the key properties of 2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine?
2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine has a molecular weight of 228.42 g/mol, XLogP of 3.40, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-N-methyl-2-N-pentan-2-ylhexane-1,2-diamine is sourced from PubChem (CID 63945751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).