2,4,4,7,7,9-hexamethyldecan-2-amine

C16H35N — CID 123931422

IUPAC2,4,4,7,7,9-hexamethyldecan-2-amine
SMILESCC(C)CC(C)(C)CCC(C)(C)CC(C)(C)N
InChIInChI=1S/C16H35N/c1-13(2)11-14(3,4)9-10-15(5,6)12-16(7,8)17/h13H,9-12,17H2,1-8H3
InChIKeyFAXZOYSWIHKXQP-UHFFFAOYSA-N
MW241.46 g/mol
LogP4.99
Rot. Bonds7

About 2,4,4,7,7,9-hexamethyldecan-2-amine

2,4,4,7,7,9-hexamethyldecan-2-amine (PubChem CID 123931422) has the molecular formula C16H35N and a molecular weight of 241.46 g/mol. Its IUPAC name is 2,4,4,7,7,9-hexamethyldecan-2-amine.

Molecular Properties

Compound Name2,4,4,7,7,9-hexamethyldecan-2-amine
PubChem CID123931422
Molecular FormulaC16H35N
Molecular Weight241.46 g/mol
Exact Mass241.28
IUPAC Name2,4,4,7,7,9-hexamethyldecan-2-amine
SMILESCC(C)CC(C)(C)CCC(C)(C)CC(C)(C)N
InChIInChI=1S/C16H35N/c1-13(2)11-14(3,4)9-10-15(5,6)12-16(7,8)17/h13H,9-12,17H2,1-8H3
InChIKeyFAXZOYSWIHKXQP-UHFFFAOYSA-N
XLogP4.99
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.46
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,4,4,7,7,9-hexamethyldecan-2-amine 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

3,3,5,5,7-pentamethyloctan-1-ol
CID 121365228
3,3,5-trimethylhexylindigane
CID 174462219
2,4,4,6,6,8,8,10,10-nonamethyltridecan-2-amine
CID 90836053
2,2,4-trimethylpentane-1,4-diamine
CID 87112848
2,4,4-trimethyldodecan-2-amine
CID 88894727
2,2,4,4,6-pentamethylheptane-1-thiol
CID 175071288
6-amino-4,4,6-trimethylheptanoic acid
CID 137482851
ethane;2,4,4-trimethylhexan-2-amine
CID 143206912
2-amino-4,4,6,6,8-pentamethylnonanoic acid
CID 145315535
(E)-2,8,8,10-tetramethylundec-4-ene
CID 59408864
N-ethylethanamine;2,2,4,4,6-pentamethylheptane
CID 177149060
7,7,9-trimethyldecane-1,3-diol
CID 57089322

Frequently Asked Questions

What is the IUPAC name of 2,4,4,7,7,9-hexamethyldecan-2-amine?
The IUPAC name of 2,4,4,7,7,9-hexamethyldecan-2-amine (CID 123931422) is 2,4,4,7,7,9-hexamethyldecan-2-amine.
What is the SMILES notation for 2,4,4,7,7,9-hexamethyldecan-2-amine?
The canonical SMILES for 2,4,4,7,7,9-hexamethyldecan-2-amine is CC(C)CC(C)(C)CCC(C)(C)CC(C)(C)N.
What is the InChIKey of 2,4,4,7,7,9-hexamethyldecan-2-amine?
The InChIKey is FAXZOYSWIHKXQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35N/c1-13(2)11-14(3,4)9-10-15(5,6)12-16(7,8)17/h13H,9-12,17H2,1-8H3.
What are the key properties of 2,4,4,7,7,9-hexamethyldecan-2-amine?
2,4,4,7,7,9-hexamethyldecan-2-amine has a molecular weight of 241.46 g/mol, XLogP of 4.99, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,4,7,7,9-hexamethyldecan-2-amine is sourced from PubChem (CID 123931422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).