N,5-dimethyl-7-methylidenedecan-3-amine

C13H27N — CID 123137171

IUPACN,5-dimethyl-7-methylidenedecan-3-amine
SMILESC=C(CCC)CC(C)CC(CC)NC
InChIInChI=1S/C13H27N/c1-6-8-11(3)9-12(4)10-13(7-2)14-5/h12-14H,3,6-10H2,1-2,4-5H3
InChIKeyUPNLTEPECCEGIF-UHFFFAOYSA-N
MW197.37 g/mol
LogP3.76
Rot. Bonds8

About N,5-dimethyl-7-methylidenedecan-3-amine

N,5-dimethyl-7-methylidenedecan-3-amine (PubChem CID 123137171) has the molecular formula C13H27N and a molecular weight of 197.37 g/mol. Its IUPAC name is N,5-dimethyl-7-methylidenedecan-3-amine.

Molecular Properties

Compound NameN,5-dimethyl-7-methylidenedecan-3-amine
PubChem CID123137171
Molecular FormulaC13H27N
Molecular Weight197.37 g/mol
Exact Mass197.21
IUPAC NameN,5-dimethyl-7-methylidenedecan-3-amine
SMILESC=C(CCC)CC(C)CC(CC)NC
InChIInChI=1S/C13H27N/c1-6-8-11(3)9-12(4)10-13(7-2)14-5/h12-14H,3,6-10H2,1-2,4-5H3
InChIKeyUPNLTEPECCEGIF-UHFFFAOYSA-N
XLogP3.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.37
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-7-methylidenedecan-3-amine?
The IUPAC name of N,5-dimethyl-7-methylidenedecan-3-amine (CID 123137171) is N,5-dimethyl-7-methylidenedecan-3-amine.
What is the SMILES notation for N,5-dimethyl-7-methylidenedecan-3-amine?
The canonical SMILES for N,5-dimethyl-7-methylidenedecan-3-amine is C=C(CCC)CC(C)CC(CC)NC.
What is the InChIKey of N,5-dimethyl-7-methylidenedecan-3-amine?
The InChIKey is UPNLTEPECCEGIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N/c1-6-8-11(3)9-12(4)10-13(7-2)14-5/h12-14H,3,6-10H2,1-2,4-5H3.
What are the key properties of N,5-dimethyl-7-methylidenedecan-3-amine?
N,5-dimethyl-7-methylidenedecan-3-amine has a molecular weight of 197.37 g/mol, XLogP of 3.76, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-7-methylidenedecan-3-amine is sourced from PubChem (CID 123137171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).