N,10-dimethyldodec-9-en-2-amine

C14H29N — CID 123170958

IUPACN,10-dimethyldodec-9-en-2-amine
SMILESCCC(C)=CCCCCCCC(C)NC
InChIInChI=1S/C14H29N/c1-5-13(2)11-9-7-6-8-10-12-14(3)15-4/h11,14-15H,5-10,12H2,1-4H3
InChIKeyVMMNERFYGKXSIF-UHFFFAOYSA-N
MW211.39 g/mol
LogP4.29
Rot. Bonds9

About N,10-dimethyldodec-9-en-2-amine

N,10-dimethyldodec-9-en-2-amine (PubChem CID 123170958) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is N,10-dimethyldodec-9-en-2-amine.

Molecular Properties

Compound NameN,10-dimethyldodec-9-en-2-amine
PubChem CID123170958
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC NameN,10-dimethyldodec-9-en-2-amine
SMILESCCC(C)=CCCCCCCC(C)NC
InChIInChI=1S/C14H29N/c1-5-13(2)11-9-7-6-8-10-12-14(3)15-4/h11,14-15H,5-10,12H2,1-4H3
InChIKeyVMMNERFYGKXSIF-UHFFFAOYSA-N
XLogP4.29
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 54.29
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

(Z)-3-methylheptadec-3-ene
CID 159647191
3-methylicos-3-ene
CID 91445266
(Z)-3-methylpentadec-3-ene
CID 14954714
3-methyloctadec-3-ene
CID 91073568
N-methyltetradecan-2-amine
CID 54073704
(E)-3-methylnon-3-ene
CID 5364647
N-methyloct-7-en-2-amine
CID 64502847
18-methylicos-17-enenitrile
CID 54078352
2-methyldec-2-ene;(E)-3-methyloct-3-ene
CID 158273122
2,9-dimethylundeca-3,8-diene
CID 54445642
(E)-N,4-dimethylhex-3-en-1-amine;ethane
CID 144566513
6,10-dimethyldodeca-5,9-dien-2-ol
CID 76600828

Frequently Asked Questions

What is the IUPAC name of N,10-dimethyldodec-9-en-2-amine?
The IUPAC name of N,10-dimethyldodec-9-en-2-amine (CID 123170958) is N,10-dimethyldodec-9-en-2-amine.
What is the SMILES notation for N,10-dimethyldodec-9-en-2-amine?
The canonical SMILES for N,10-dimethyldodec-9-en-2-amine is CCC(C)=CCCCCCCC(C)NC.
What is the InChIKey of N,10-dimethyldodec-9-en-2-amine?
The InChIKey is VMMNERFYGKXSIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-5-13(2)11-9-7-6-8-10-12-14(3)15-4/h11,14-15H,5-10,12H2,1-4H3.
What are the key properties of N,10-dimethyldodec-9-en-2-amine?
N,10-dimethyldodec-9-en-2-amine has a molecular weight of 211.39 g/mol, XLogP of 4.29, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,10-dimethyldodec-9-en-2-amine is sourced from PubChem (CID 123170958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).