8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-amine

C17H35N — CID 167085291

IUPAC8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-amine
SMILESC=C(CCC(C)C)NCCCCCCCC(C)C
InChIInChI=1S/C17H35N/c1-15(2)11-9-7-6-8-10-14-18-17(5)13-12-16(3)4/h15-16,18H,5-14H2,1-4H3
InChIKeyYRMLLYOHGUMZDX-UHFFFAOYSA-N
MW253.47 g/mol
LogP5.52
Rot. Bonds12

About 8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-amine

8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-amine (PubChem CID 167085291) has the molecular formula C17H35N and a molecular weight of 253.47 g/mol. Its IUPAC name is 8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-amine.

Molecular Properties

Compound Name8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-amine
PubChem CID167085291
Molecular FormulaC17H35N
Molecular Weight253.47 g/mol
Exact Mass253.28
IUPAC Name8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-amine
SMILESC=C(CCC(C)C)NCCCCCCCC(C)C
InChIInChI=1S/C17H35N/c1-15(2)11-9-7-6-8-10-14-18-17(5)13-12-16(3)4/h15-16,18H,5-14H2,1-4H3
InChIKeyYRMLLYOHGUMZDX-UHFFFAOYSA-N
XLogP5.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500253.47
LogP ≤ 55.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-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

14-methyl-N-(4-methylpentyl)pentadec-1-en-2-amine
CID 170250998
N-hept-1-en-2-yl-6-methylheptan-1-amine
CID 155148528
5-methyl-N-(4-methylpent-1-en-2-yl)hexan-1-amine
CID 139520172
4-methyl-N-(6-methylheptyl)pentanamide
CID 129055781
N-(3,3-dimethylbut-1-en-2-yl)-8-methylnonan-1-amine
CID 166800769
5-methyl-N-(2-methylpropyl)hex-1-en-2-amine
CID 153336288
2-methyl-N-(6-methylheptyl)propanamide
CID 139441078
1-methyl-3-(7-methyloctyl)urea
CID 71899901
4-methyl-N-[3-[[3-[[3-[5-[3-[3-[3-(4-methylpentanoylamino)propanoylamino]propanoylamino]propanoylamino]pentylamino]-3-oxopropyl]amino]-3-oxopropyl]amino]-3-oxopropyl]pentanamide
CID 59046039
(3S)-7-(dec-1-en-2-ylamino)-3-methylheptan-2-one
CID 163498407
N-(4-methylpentyl)-9-(prop-1-en-2-ylamino)nonanamide
CID 168959940
N-(7-methyloctyl)-3-sulfanylpropanamide
CID 107818548

Frequently Asked Questions

What is the IUPAC name of 8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-amine?
The IUPAC name of 8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-amine (CID 167085291) is 8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-amine.
What is the SMILES notation for 8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-amine?
The canonical SMILES for 8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-amine is C=C(CCC(C)C)NCCCCCCCC(C)C.
What is the InChIKey of 8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-amine?
The InChIKey is YRMLLYOHGUMZDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N/c1-15(2)11-9-7-6-8-10-14-18-17(5)13-12-16(3)4/h15-16,18H,5-14H2,1-4H3.
What are the key properties of 8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-amine?
8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-amine has a molecular weight of 253.47 g/mol, XLogP of 5.52, 12 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-N-(5-methylhex-1-en-2-yl)nonan-1-amine is sourced from PubChem (CID 167085291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).