N-(4,6-dimethylnon-3-enyl)cyclopropanamine

C14H27N — CID 79606790

IUPACN-(4,6-dimethylnon-3-enyl)cyclopropanamine
SMILESCCCC(C)CC(C)=CCCNC1CC1
InChIInChI=1S/C14H27N/c1-4-6-12(2)11-13(3)7-5-10-15-14-8-9-14/h7,12,14-15H,4-6,8-11H2,1-3H3
InChIKeyDEIDCDNJVLNRNH-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.90
Rot. Bonds8

About N-(4,6-dimethylnon-3-enyl)cyclopropanamine

N-(4,6-dimethylnon-3-enyl)cyclopropanamine (PubChem CID 79606790) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is N-(4,6-dimethylnon-3-enyl)cyclopropanamine.

Molecular Properties

Compound NameN-(4,6-dimethylnon-3-enyl)cyclopropanamine
PubChem CID79606790
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC NameN-(4,6-dimethylnon-3-enyl)cyclopropanamine
SMILESCCCC(C)CC(C)=CCCNC1CC1
InChIInChI=1S/C14H27N/c1-4-6-12(2)11-13(3)7-5-10-15-14-8-9-14/h7,12,14-15H,4-6,8-11H2,1-3H3
InChIKeyDEIDCDNJVLNRNH-UHFFFAOYSA-N
XLogP3.90
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(4,6-dimethyloct-3-enyl)cyclopropanamine
CID 79598638
N,4,6-trimethylnon-3-en-1-amine
CID 79599077
N-(4-methyl-5-propan-2-yloxypent-3-enyl)cyclopropanamine
CID 79599787
N-(5-methoxy-4-methylpent-3-enyl)cyclopropanamine
CID 79598630
N-(6-methoxy-4,5-dimethylhex-3-enyl)cyclopropanamine
CID 104863204
N-cyclopropyl-3-methylhexanamide
CID 155359047
N-[4-(4-ethylcyclohexyl)pent-3-enyl]cyclopropanamine
CID 79598240
N'-cyclopropyl-2-methylbutane-1,4-diamine
CID 79001550
N-(3-methyloctyl)cyclopropanamine
CID 81018953
N-tert-butyl-4,6-dimethyloct-3-en-1-amine
CID 79607887
N,N'-dicyclopropyl-4-methylheptane-1,7-diamine
CID 66322125
N-(4-methylhexyl)cyclopropanamine
CID 62529631

Frequently Asked Questions

What is the IUPAC name of N-(4,6-dimethylnon-3-enyl)cyclopropanamine?
The IUPAC name of N-(4,6-dimethylnon-3-enyl)cyclopropanamine (CID 79606790) is N-(4,6-dimethylnon-3-enyl)cyclopropanamine.
What is the SMILES notation for N-(4,6-dimethylnon-3-enyl)cyclopropanamine?
The canonical SMILES for N-(4,6-dimethylnon-3-enyl)cyclopropanamine is CCCC(C)CC(C)=CCCNC1CC1.
What is the InChIKey of N-(4,6-dimethylnon-3-enyl)cyclopropanamine?
The InChIKey is DEIDCDNJVLNRNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-4-6-12(2)11-13(3)7-5-10-15-14-8-9-14/h7,12,14-15H,4-6,8-11H2,1-3H3.
What are the key properties of N-(4,6-dimethylnon-3-enyl)cyclopropanamine?
N-(4,6-dimethylnon-3-enyl)cyclopropanamine has a molecular weight of 209.38 g/mol, XLogP of 3.90, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,6-dimethylnon-3-enyl)cyclopropanamine is sourced from PubChem (CID 79606790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).