N,9,9-trimethyl-6-methylideneundecan-2-amine

C15H31N — CID 18716554

IUPACN,9,9-trimethyl-6-methylideneundecan-2-amine
SMILESC=C(CCCC(C)NC)CCC(C)(C)CC
InChIInChI=1S/C15H31N/c1-7-15(4,5)12-11-13(2)9-8-10-14(3)16-6/h14,16H,2,7-12H2,1,3-6H3
InChIKeyMDQWBHNLSXUSBY-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.54
Rot. Bonds9

About N,9,9-trimethyl-6-methylideneundecan-2-amine

N,9,9-trimethyl-6-methylideneundecan-2-amine (PubChem CID 18716554) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is N,9,9-trimethyl-6-methylideneundecan-2-amine.

Molecular Properties

Compound NameN,9,9-trimethyl-6-methylideneundecan-2-amine
PubChem CID18716554
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC NameN,9,9-trimethyl-6-methylideneundecan-2-amine
SMILESC=C(CCCC(C)NC)CCC(C)(C)CC
InChIInChI=1S/C15H31N/c1-7-15(4,5)12-11-13(2)9-8-10-14(3)16-6/h14,16H,2,7-12H2,1,3-6H3
InChIKeyMDQWBHNLSXUSBY-UHFFFAOYSA-N
XLogP4.54
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N,9,9-trimethyl-6-methylideneundecan-2-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

2-fluoro-N-methyl-6-prop-1-en-2-ylcycloheptan-1-amine
CID 123961973
8-fluoro-N,2-dimethyl-3-methylideneoctan-4-amine
CID 134571051
4-[(1E)-cycloocten-1-yl]-4-methyl-N-propan-2-ylpentan-1-amine
CID 10922993
9,9-Dimethyl-6-methylideneundecan-2-amine
CID 18716549
2-N,4,11,11-tetramethyl-8-methylidenetridecane-2,4-diamine
CID 18716552
2-N,4-dimethyl-8-methylideneundecane-2,4-diamine
CID 18716553
3-tert-butyl-3a,4,5,6,7,7a-hexahydro-1H-indole
CID 20744138
(2S)-2-(3,3-dimethylbut-1-en-2-yl)pyrrolidine
CID 58274550
(2S)-2-(3,3-dimethylbut-1-en-2-yl)piperidine
CID 58274636
N-methyl-4-(2-methylprop-2-enyl)cyclohexan-1-amine
CID 58398176
2-(3-methylbut-1-en-2-yl)-N-propan-2-ylcyclopentan-1-amine
CID 58718140
3-(3-methylbut-1-en-2-yl)-N-propan-2-ylcyclopentan-1-amine
CID 58718142

Frequently Asked Questions

What is the IUPAC name of N,9,9-trimethyl-6-methylideneundecan-2-amine?
The IUPAC name of N,9,9-trimethyl-6-methylideneundecan-2-amine (CID 18716554) is N,9,9-trimethyl-6-methylideneundecan-2-amine.
What is the SMILES notation for N,9,9-trimethyl-6-methylideneundecan-2-amine?
The canonical SMILES for N,9,9-trimethyl-6-methylideneundecan-2-amine is C=C(CCCC(C)NC)CCC(C)(C)CC.
What is the InChIKey of N,9,9-trimethyl-6-methylideneundecan-2-amine?
The InChIKey is MDQWBHNLSXUSBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-7-15(4,5)12-11-13(2)9-8-10-14(3)16-6/h14,16H,2,7-12H2,1,3-6H3.
What are the key properties of N,9,9-trimethyl-6-methylideneundecan-2-amine?
N,9,9-trimethyl-6-methylideneundecan-2-amine has a molecular weight of 225.42 g/mol, XLogP of 4.54, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,9,9-trimethyl-6-methylideneundecan-2-amine is sourced from PubChem (CID 18716554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).