2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-1,2-diamine

C16H34N2 — CID 63465210

IUPAC2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-1,2-diamine
SMILESCCCCCCCC(CN)N(CC(C)C)C1CC1
InChIInChI=1S/C16H34N2/c1-4-5-6-7-8-9-16(12-17)18(13-14(2)3)15-10-11-15/h14-16H,4-13,17H2,1-3H3
InChIKeyWDRXOHOAKPQSGU-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.79
Rot. Bonds11

About 2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-1,2-diamine

2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-1,2-diamine (PubChem CID 63465210) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-1,2-diamine.

Molecular Properties

Compound Name2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-1,2-diamine
PubChem CID63465210
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-1,2-diamine
SMILESCCCCCCCC(CN)N(CC(C)C)C1CC1
InChIInChI=1S/C16H34N2/c1-4-5-6-7-8-9-16(12-17)18(13-14(2)3)15-10-11-15/h14-16H,4-13,17H2,1-3H3
InChIKeyWDRXOHOAKPQSGU-UHFFFAOYSA-N
XLogP3.79
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-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-butyl-2-N-cyclopropylhexane-1,2-diamine
CID 61440730
2-N,2-N-bis(2-methylpropyl)heptane-1,2-diamine
CID 55193032
2-N-ethyl-2-N-(2-methylpropyl)octane-1,2-diamine
CID 43273520
4-N-cyclopropyl-4-N-(2-methylpropyl)pentane-1,4-diamine
CID 62430254
2-N,2-N-bis(3-methylbutyl)nonane-1,2-diamine
CID 107869547
2-N-butyl-2-N-cyclopropyl-4-methylpentane-1,2-diamine
CID 61441066
2-N-methyl-2-N-(3-methylbutyl)nonane-1,2-diamine
CID 55193416
2-N,2-N-bis(3-methylbutyl)heptane-1,2-diamine
CID 107869478
4-N-ethyl-4-N-heptan-2-ylcyclohexane-1,4-diamine
CID 80557958
2-N-[2-(dimethylamino)ethyl]-2-N-(2-methylpropyl)nonane-1,2-diamine
CID 63466838
2-N-[2-(dimethylamino)ethyl]-2-N-(2-methylpropyl)octane-1,2-diamine
CID 55011655
2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)octane-1,2-diamine
CID 54987130

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-1,2-diamine?
The IUPAC name of 2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-1,2-diamine (CID 63465210) is 2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-1,2-diamine.
What is the SMILES notation for 2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-1,2-diamine?
The canonical SMILES for 2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-1,2-diamine is CCCCCCCC(CN)N(CC(C)C)C1CC1.
What is the InChIKey of 2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-1,2-diamine?
The InChIKey is WDRXOHOAKPQSGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-4-5-6-7-8-9-16(12-17)18(13-14(2)3)15-10-11-15/h14-16H,4-13,17H2,1-3H3.
What are the key properties of 2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-1,2-diamine?
2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-1,2-diamine has a molecular weight of 254.46 g/mol, XLogP of 3.79, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopropyl-2-N-(2-methylpropyl)nonane-1,2-diamine is sourced from PubChem (CID 63465210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).