2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-1,2-diamine

C16H34N2O — CID 61452960

IUPAC2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-1,2-diamine
SMILESCCCCCCCC(C)(CN)N(CCOC)C1CC1
InChIInChI=1S/C16H34N2O/c1-4-5-6-7-8-11-16(2,14-17)18(12-13-19-3)15-9-10-15/h15H,4-14,17H2,1-3H3
InChIKeyKUIXDMRTGDWUKB-UHFFFAOYSA-N
MW270.46 g/mol
LogP3.18
Rot. Bonds12

About 2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-1,2-diamine

2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-1,2-diamine (PubChem CID 61452960) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is 2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-1,2-diamine.

Molecular Properties

Compound Name2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-1,2-diamine
PubChem CID61452960
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Name2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-1,2-diamine
SMILESCCCCCCCC(C)(CN)N(CCOC)C1CC1
InChIInChI=1S/C16H34N2O/c1-4-5-6-7-8-11-16(2,14-17)18(12-13-19-3)15-9-10-15/h15H,4-14,17H2,1-3H3
InChIKeyKUIXDMRTGDWUKB-UHFFFAOYSA-N
XLogP3.18
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-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-cyclopropyl-2-methyl-2-N-(3-methylbutyl)nonane-1,2-diamine
CID 78944020
2-N-cyclopropyl-2-methyl-2-N-(3-methylbutyl)heptane-1,2-diamine
CID 80558361
2-N-cyclopropyl-2-methyl-2-N-(2-methylpropyl)nonane-1,2-diamine
CID 63465034
2-N,2-N-bis(2-methoxyethyl)-2-methylheptane-1,2-diamine
CID 112723382
2-N-cyclopropyl-2-ethyl-2-N-(2-methoxyethyl)hexane-1,2-diamine
CID 63947357
2-N-cyclopropyl-2-N,2-dimethylnonane-1,2-diamine
CID 43264803
2-N-cycloheptyl-2-N,2-dimethylnonane-1,2-diamine
CID 43613910
2-N-cyclopropyl-2-methyl-2-N-(thiophen-3-ylmethyl)nonane-1,2-diamine
CID 63470809
2-N-cyclopropyl-2-N-ethyl-3-methoxy-2-methylpropane-1,2-diamine
CID 62537022
2-N-(cyclobutylmethyl)-2-N-ethyl-2-methyloctane-1,2-diamine
CID 107397828
2-N,2-dimethyl-2-N-pentylnonane-1,2-diamine
CID 43294671
2-N-butyl-2-N,2-dimethylnonane-1,2-diamine
CID 43089517

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-1,2-diamine?
The IUPAC name of 2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-1,2-diamine (CID 61452960) is 2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-1,2-diamine.
What is the SMILES notation for 2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-1,2-diamine?
The canonical SMILES for 2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-1,2-diamine is CCCCCCCC(C)(CN)N(CCOC)C1CC1.
What is the InChIKey of 2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-1,2-diamine?
The InChIKey is KUIXDMRTGDWUKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-4-5-6-7-8-11-16(2,14-17)18(12-13-19-3)15-9-10-15/h15H,4-14,17H2,1-3H3.
What are the key properties of 2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-1,2-diamine?
2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-1,2-diamine has a molecular weight of 270.46 g/mol, XLogP of 3.18, 12 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopropyl-2-N-(2-methoxyethyl)-2-methylnonane-1,2-diamine is sourced from PubChem (CID 61452960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).