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

C15H34N2 — CID 43271963

IUPAC2-N,2-dimethyl-2-N-(2-methylpropyl)nonane-1,2-diamine
SMILESCCCCCCCC(C)(CN)N(C)CC(C)C
InChIInChI=1S/C15H34N2/c1-6-7-8-9-10-11-15(4,13-16)17(5)12-14(2)3/h14H,6-13,16H2,1-5H3
InChIKeyKLEIMODNKRQUIT-UHFFFAOYSA-N
MW242.45 g/mol
LogP3.65
Rot. Bonds10

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

2-N,2-dimethyl-2-N-(2-methylpropyl)nonane-1,2-diamine (PubChem CID 43271963) has the molecular formula C15H34N2 and a molecular weight of 242.45 g/mol. Its IUPAC name is 2-N,2-dimethyl-2-N-(2-methylpropyl)nonane-1,2-diamine.

Molecular Properties

Compound Name2-N,2-dimethyl-2-N-(2-methylpropyl)nonane-1,2-diamine
PubChem CID43271963
Molecular FormulaC15H34N2
Molecular Weight242.45 g/mol
Exact Mass242.27
IUPAC Name2-N,2-dimethyl-2-N-(2-methylpropyl)nonane-1,2-diamine
SMILESCCCCCCCC(C)(CN)N(C)CC(C)C
InChIInChI=1S/C15H34N2/c1-6-7-8-9-10-11-15(4,13-16)17(5)12-14(2)3/h14H,6-13,16H2,1-5H3
InChIKeyKLEIMODNKRQUIT-UHFFFAOYSA-N
XLogP3.65
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.45
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-N,2-dimethyl-2-N-pentylnonane-1,2-diamine
CID 43294671
2-N-butyl-2-N,2-dimethylnonane-1,2-diamine
CID 43089517
2-methyl-2-N,2-N-bis(3-methylbutyl)octane-1,2-diamine
CID 107869523
2-N,2-dimethyl-2-N-(2-propan-2-yloxyethyl)heptane-1,2-diamine
CID 81059026
2-N-cyclopropyl-2-methyl-2-N-(2-methylpropyl)nonane-1,2-diamine
CID 63465034
2-N-[2-(dimethylamino)ethyl]-2-N,2-dimethylnonane-1,2-diamine
CID 55227526
2-N,2-dimethyl-2-N-pentan-2-yloctane-1,2-diamine
CID 43571908
2-N,2-dimethyl-2-N-pentan-2-ylheptane-1,2-diamine
CID 80558210
2-N,2-dimethyl-2-N-(3-methylsulfanylpropyl)octane-1,2-diamine
CID 114236764
2-N-ethyl-2-methyl-2-N-propan-2-ylheptane-1,2-diamine
CID 80558248
2-N-cyclopropyl-2-methyl-2-N-(3-methylbutyl)nonane-1,2-diamine
CID 78944020
N,N,2-trimethyltridecan-2-amine;hydrochloride
CID 175023190

Frequently Asked Questions

What is the IUPAC name of 2-N,2-dimethyl-2-N-(2-methylpropyl)nonane-1,2-diamine?
The IUPAC name of 2-N,2-dimethyl-2-N-(2-methylpropyl)nonane-1,2-diamine (CID 43271963) is 2-N,2-dimethyl-2-N-(2-methylpropyl)nonane-1,2-diamine.
What is the SMILES notation for 2-N,2-dimethyl-2-N-(2-methylpropyl)nonane-1,2-diamine?
The canonical SMILES for 2-N,2-dimethyl-2-N-(2-methylpropyl)nonane-1,2-diamine is CCCCCCCC(C)(CN)N(C)CC(C)C.
What is the InChIKey of 2-N,2-dimethyl-2-N-(2-methylpropyl)nonane-1,2-diamine?
The InChIKey is KLEIMODNKRQUIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34N2/c1-6-7-8-9-10-11-15(4,13-16)17(5)12-14(2)3/h14H,6-13,16H2,1-5H3.
What are the key properties of 2-N,2-dimethyl-2-N-(2-methylpropyl)nonane-1,2-diamine?
2-N,2-dimethyl-2-N-(2-methylpropyl)nonane-1,2-diamine has a molecular weight of 242.45 g/mol, XLogP of 3.65, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-dimethyl-2-N-(2-methylpropyl)nonane-1,2-diamine is sourced from PubChem (CID 43271963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).