1-[benzyl(dimethylamino)amino]propylidenechromium

C12H18CrN2 — CID 11772603

IUPAC1-[benzyl(dimethylamino)amino]propylidenechromium
SMILESCCC(=[Cr])N(Cc1ccccc1)N(C)C
InChIInChI=1S/C12H18N2.Cr/c1-4-10-14(13(2)3)11-12-8-6-5-7-9-12;/h5-9H,4,11H2,1-3H3;
InChIKeyNRAYWMURUYAOSB-UHFFFAOYSA-N
MW242.29 g/mol
LogP2.05
Rot. Bonds5

About 1-[benzyl(dimethylamino)amino]propylidenechromium

1-[benzyl(dimethylamino)amino]propylidenechromium (PubChem CID 11772603) has the molecular formula C12H18CrN2 and a molecular weight of 242.29 g/mol. Its IUPAC name is 1-[benzyl(dimethylamino)amino]propylidenechromium.

Molecular Properties

Compound Name1-[benzyl(dimethylamino)amino]propylidenechromium
PubChem CID11772603
Molecular FormulaC12H18CrN2
Molecular Weight242.29 g/mol
Exact Mass242.09
IUPAC Name1-[benzyl(dimethylamino)amino]propylidenechromium
SMILESCCC(=[Cr])N(Cc1ccccc1)N(C)C
InChIInChI=1S/C12H18N2.Cr/c1-4-10-14(13(2)3)11-12-8-6-5-7-9-12;/h5-9H,4,11H2,1-3H3;
InChIKeyNRAYWMURUYAOSB-UHFFFAOYSA-N
XLogP2.05
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.29
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-[benzyl(dimethylamino)amino]propylidenechromium 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

1-benzyl-1,2,2-trimethylhydrazine
CID 23468062
N,N-bis(ethylamino)-1-phenylmethanamine
CID 139752469
benzyl(diethylamino)carbamic acid
CID 151208829
N-benzyl-N-methylethanamine;N,N-dimethylethanamine;ethane
CID 159486837
N,N-dimethyl-1-phenylmethanamine;hydrobromide
CID 71398520
N,N-dimethyl-1-phenylmethanamine;phosphane
CID 174524909
N,N-dimethyl-1-phenylmethanamine;tetrahydrochloride
CID 172854351
benzene;N,N-dimethyl-1-phenylmethanamine;ethane
CID 90785154
(E)-1-[benzyl(methyl)amino]pent-1-en-3-one
CID 122202331
N-benzyl-N-ethylethanamine;methanethiol
CID 142975470
carbonic acid;N,N-dimethyl-1-phenylmethanamine
CID 69138278
1-benzyl-1,3-diethyl-3-methylurea
CID 116654057

Frequently Asked Questions

What is the IUPAC name of 1-[benzyl(dimethylamino)amino]propylidenechromium?
The IUPAC name of 1-[benzyl(dimethylamino)amino]propylidenechromium (CID 11772603) is 1-[benzyl(dimethylamino)amino]propylidenechromium.
What is the SMILES notation for 1-[benzyl(dimethylamino)amino]propylidenechromium?
The canonical SMILES for 1-[benzyl(dimethylamino)amino]propylidenechromium is CCC(=[Cr])N(Cc1ccccc1)N(C)C.
What is the InChIKey of 1-[benzyl(dimethylamino)amino]propylidenechromium?
The InChIKey is NRAYWMURUYAOSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2.Cr/c1-4-10-14(13(2)3)11-12-8-6-5-7-9-12;/h5-9H,4,11H2,1-3H3;.
What are the key properties of 1-[benzyl(dimethylamino)amino]propylidenechromium?
1-[benzyl(dimethylamino)amino]propylidenechromium has a molecular weight of 242.29 g/mol, XLogP of 2.05, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[benzyl(dimethylamino)amino]propylidenechromium is sourced from PubChem (CID 11772603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).