4-[(hexylhydrazinylidene)methyl]-N,N-dimethylaniline

C15H25N3 — CID 154982727

IUPAC4-[(hexylhydrazinylidene)methyl]-N,N-dimethylaniline
SMILESCCCCCCNN=Cc1ccc(N(C)C)cc1
InChIInChI=1S/C15H25N3/c1-4-5-6-7-12-16-17-13-14-8-10-15(11-9-14)18(2)3/h8-11,13,16H,4-7,12H2,1-3H3
InChIKeyYWPXMCVNJMYAKL-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.26
Rot. Bonds8

About 4-[(hexylhydrazinylidene)methyl]-N,N-dimethylaniline

4-[(hexylhydrazinylidene)methyl]-N,N-dimethylaniline (PubChem CID 154982727) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 4-[(hexylhydrazinylidene)methyl]-N,N-dimethylaniline.

Molecular Properties

Compound Name4-[(hexylhydrazinylidene)methyl]-N,N-dimethylaniline
PubChem CID154982727
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name4-[(hexylhydrazinylidene)methyl]-N,N-dimethylaniline
SMILESCCCCCCNN=Cc1ccc(N(C)C)cc1
InChIInChI=1S/C15H25N3/c1-4-5-6-7-12-16-17-13-14-8-10-15(11-9-14)18(2)3/h8-11,13,16H,4-7,12H2,1-3H3
InChIKeyYWPXMCVNJMYAKL-UHFFFAOYSA-N
XLogP3.26
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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'}

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Related Compounds

1-[[4-(dimethylamino)phenyl]methylideneamino]-3-dodecylthiourea
CID 3978201
4-(decyliminomethyl)-N,N-dimethylaniline
CID 160905349
N-(benzylideneamino)butan-1-amine
CID 173252252
N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-N'-[(Z)-[4-(dimethylamino)phenyl]methylideneamino]hexanediamide
CID 92856210
N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]propanamide
CID 22613567
cis-(1S,2S)-N-[[4-(dimethylamino)phenyl]methylideneamino]-2-pentylcyclopropane-1-carboxamide
CID 129360319
1-N-butyl-4-N,4-N-dimethylbenzene-1,4-diamine
CID 18322589
4-[(E)-hept-1-enyl]-N,N-dimethylaniline
CID 101050911
1-[(Z)-[4-(dimethylamino)phenyl]methylideneamino]-3-[[4-(dimethylamino)phenyl]methylideneamino]urea
CID 5355984
1-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-3-ethylthiourea
CID 7728669
2-[(pentylhydrazinylidene)methyl]phenol
CID 173213251
N-[[4-(diethylamino)phenyl]methylideneamino]octanamide
CID 3333467

Frequently Asked Questions

What is the IUPAC name of 4-[(hexylhydrazinylidene)methyl]-N,N-dimethylaniline?
The IUPAC name of 4-[(hexylhydrazinylidene)methyl]-N,N-dimethylaniline (CID 154982727) is 4-[(hexylhydrazinylidene)methyl]-N,N-dimethylaniline.
What is the SMILES notation for 4-[(hexylhydrazinylidene)methyl]-N,N-dimethylaniline?
The canonical SMILES for 4-[(hexylhydrazinylidene)methyl]-N,N-dimethylaniline is CCCCCCNN=Cc1ccc(N(C)C)cc1.
What is the InChIKey of 4-[(hexylhydrazinylidene)methyl]-N,N-dimethylaniline?
The InChIKey is YWPXMCVNJMYAKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-4-5-6-7-12-16-17-13-14-8-10-15(11-9-14)18(2)3/h8-11,13,16H,4-7,12H2,1-3H3.
What are the key properties of 4-[(hexylhydrazinylidene)methyl]-N,N-dimethylaniline?
4-[(hexylhydrazinylidene)methyl]-N,N-dimethylaniline has a molecular weight of 247.39 g/mol, XLogP of 3.26, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(hexylhydrazinylidene)methyl]-N,N-dimethylaniline is sourced from PubChem (CID 154982727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).