N,3-dimethyl-4-(2-methylcyclobutyl)nonan-3-amine

C16H33N — CID 139564563

IUPACN,3-dimethyl-4-(2-methylcyclobutyl)nonan-3-amine
SMILESCCCCCC(C1CCC1C)C(C)(CC)NC
InChIInChI=1S/C16H33N/c1-6-8-9-10-15(14-12-11-13(14)3)16(4,7-2)17-5/h13-15,17H,6-12H2,1-5H3
InChIKeyUGAGCTKFAWLMCW-UHFFFAOYSA-N
MW239.45 g/mol
LogP4.62
Rot. Bonds8

About N,3-dimethyl-4-(2-methylcyclobutyl)nonan-3-amine

N,3-dimethyl-4-(2-methylcyclobutyl)nonan-3-amine (PubChem CID 139564563) has the molecular formula C16H33N and a molecular weight of 239.45 g/mol. Its IUPAC name is N,3-dimethyl-4-(2-methylcyclobutyl)nonan-3-amine.

Molecular Properties

Compound NameN,3-dimethyl-4-(2-methylcyclobutyl)nonan-3-amine
PubChem CID139564563
Molecular FormulaC16H33N
Molecular Weight239.45 g/mol
Exact Mass239.26
IUPAC NameN,3-dimethyl-4-(2-methylcyclobutyl)nonan-3-amine
SMILESCCCCCC(C1CCC1C)C(C)(CC)NC
InChIInChI=1S/C16H33N/c1-6-8-9-10-15(14-12-11-13(14)3)16(4,7-2)17-5/h13-15,17H,6-12H2,1-5H3
InChIKeyUGAGCTKFAWLMCW-UHFFFAOYSA-N
XLogP4.62
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.45
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(1S,2R,4S)-2-henicosan-11-yl-1,4-dimethylcyclohexane
CID 98523786
2-decan-4-yl-1,4-dimethylcyclohexane
CID 123729165
N-methyl-1-(2-methylcyclopropyl)undecan-1-amine
CID 65419745
1-heptan-2-yl-2-methylcyclopropane
CID 91084036
N-methyl-1-(4-methylcyclohexyl)nonan-1-amine
CID 63415649
1-(2-methylcyclopentyl)heptylhydrazine
CID 107193564
1-(2-methylcyclopentyl)heptan-1-ol
CID 15118791
1-(2-methylcyclopentyl)heptan-1-amine
CID 107188178
1,2-dimethylcyclobutane;pentane
CID 142846915
1,2-dimethyl-4-octan-3-yl-3-propan-2-ylcyclohexane
CID 90877795
1,1,1-tripropoxydecan-2-ylcyclopropane
CID 151363480
ethane;1-methyl-4-(2-methyl-3-propyloctan-2-yl)cyclohexane
CID 143303479

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-4-(2-methylcyclobutyl)nonan-3-amine?
The IUPAC name of N,3-dimethyl-4-(2-methylcyclobutyl)nonan-3-amine (CID 139564563) is N,3-dimethyl-4-(2-methylcyclobutyl)nonan-3-amine.
What is the SMILES notation for N,3-dimethyl-4-(2-methylcyclobutyl)nonan-3-amine?
The canonical SMILES for N,3-dimethyl-4-(2-methylcyclobutyl)nonan-3-amine is CCCCCC(C1CCC1C)C(C)(CC)NC.
What is the InChIKey of N,3-dimethyl-4-(2-methylcyclobutyl)nonan-3-amine?
The InChIKey is UGAGCTKFAWLMCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N/c1-6-8-9-10-15(14-12-11-13(14)3)16(4,7-2)17-5/h13-15,17H,6-12H2,1-5H3.
What are the key properties of N,3-dimethyl-4-(2-methylcyclobutyl)nonan-3-amine?
N,3-dimethyl-4-(2-methylcyclobutyl)nonan-3-amine has a molecular weight of 239.45 g/mol, XLogP of 4.62, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-4-(2-methylcyclobutyl)nonan-3-amine is sourced from PubChem (CID 139564563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).