2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine

C15H32N2 — CID 21412758

IUPAC2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine
SMILESCCCCCCCCC/C(C)=N/NC(C)(C)C
InChIInChI=1S/C15H32N2/c1-6-7-8-9-10-11-12-13-14(2)16-17-15(3,4)5/h17H,6-13H2,1-5H3/b16-14+
InChIKeyFSZATNYIABPVDP-JQIJEIRASA-N
MW240.43 g/mol
LogP4.89
Rot. Bonds9

About 2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine

2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine (PubChem CID 21412758) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is 2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine
PubChem CID21412758
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC Name2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine
SMILESCCCCCCCCC/C(C)=N/NC(C)(C)C
InChIInChI=1S/C15H32N2/c1-6-7-8-9-10-11-12-13-14(2)16-17-15(3,4)5/h17H,6-13H2,1-5H3/b16-14+
InChIKeyFSZATNYIABPVDP-JQIJEIRASA-N
XLogP4.89
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-methyl-N-[(E)-undecan-2-ylideneamino]propan-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

N,N'-bis(undecan-2-ylideneamino)oxamide
CID 3097994
4-(tert-butylhydrazinylidene)pentanoic acid
CID 88817023
N-(hexan-2-ylideneamino)heptanamide
CID 4616391
N-(hexan-2-ylideneamino)octanamide
CID 4148475
N-tridecan-2-ylidenehydroxylamine
CID 74054313
N-tetradecan-2-ylidenehydroxylamine
CID 140688122
(NE,R)-N-decan-2-ylidene-2-methylpropane-2-sulfinamide
CID 16753574
N-[(E)-undecan-2-ylideneamino]aniline
CID 5356948
N-(pentan-2-ylideneamino)undecanamide
CID 3423517
N-[(Z)-decan-2-ylideneamino]-N-methylmethanamine
CID 6506660
(nonadec-10-en-2-ylideneamino)urea
CID 71326598
2-(nonan-2-ylideneamino)guanidine
CID 76873061

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine?
The IUPAC name of 2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine (CID 21412758) is 2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine?
The canonical SMILES for 2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine is CCCCCCCCC/C(C)=N/NC(C)(C)C.
What is the InChIKey of 2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine?
The InChIKey is FSZATNYIABPVDP-JQIJEIRASA-N. The full InChI is InChI=1S/C15H32N2/c1-6-7-8-9-10-11-12-13-14(2)16-17-15(3,4)5/h17H,6-13H2,1-5H3/b16-14+.
What are the key properties of 2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine?
2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine has a molecular weight of 240.43 g/mol, XLogP of 4.89, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine is sourced from PubChem (CID 21412758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).