N,N-bis(ethylamino)-1-phenylmethanamine

C11H19N3 — CID 139752469

IUPACN,N-bis(ethylamino)-1-phenylmethanamine
SMILESCCNN(Cc1ccccc1)NCC
InChIInChI=1S/C11H19N3/c1-3-12-14(13-4-2)10-11-8-6-5-7-9-11/h5-9,12-13H,3-4,10H2,1-2H3
InChIKeyMGTCOZOBLOSJEJ-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.54
Rot. Bonds6

About N,N-bis(ethylamino)-1-phenylmethanamine

N,N-bis(ethylamino)-1-phenylmethanamine (PubChem CID 139752469) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is N,N-bis(ethylamino)-1-phenylmethanamine.

Molecular Properties

Compound NameN,N-bis(ethylamino)-1-phenylmethanamine
PubChem CID139752469
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC NameN,N-bis(ethylamino)-1-phenylmethanamine
SMILESCCNN(Cc1ccccc1)NCC
InChIInChI=1S/C11H19N3/c1-3-12-14(13-4-2)10-11-8-6-5-7-9-11/h5-9,12-13H,3-4,10H2,1-2H3
InChIKeyMGTCOZOBLOSJEJ-UHFFFAOYSA-N
XLogP1.54
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N,N-bis(ethylamino)-1-phenylmethanamine 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

1,2-dibenzyl-1-methylhydrazine
CID 57145827
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
N,N-dimethyl-1-phenylmethanamine;ethane;N-methylmethanamine
CID 91426963
N,N-dimethyl-1-phenylmethanamine;gold(3+);dichloride
CID 71592559
1-benzyl-1,2,2-trimethylhydrazine
CID 23468062
ethylamino(phenyl)carbamic acid
CID 159582603
N,N-dimethyl-1-phenylmethanamine;N-ethyl-N-methylethanamine
CID 154948707
N-benzyl-N-methylethanamine;N,N-dimethylethanamine;ethane
CID 159486837
N-benzyl-N-methylbutan-2-amine
CID 15496809

Frequently Asked Questions

What is the IUPAC name of N,N-bis(ethylamino)-1-phenylmethanamine?
The IUPAC name of N,N-bis(ethylamino)-1-phenylmethanamine (CID 139752469) is N,N-bis(ethylamino)-1-phenylmethanamine.
What is the SMILES notation for N,N-bis(ethylamino)-1-phenylmethanamine?
The canonical SMILES for N,N-bis(ethylamino)-1-phenylmethanamine is CCNN(Cc1ccccc1)NCC.
What is the InChIKey of N,N-bis(ethylamino)-1-phenylmethanamine?
The InChIKey is MGTCOZOBLOSJEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-3-12-14(13-4-2)10-11-8-6-5-7-9-11/h5-9,12-13H,3-4,10H2,1-2H3.
What are the key properties of N,N-bis(ethylamino)-1-phenylmethanamine?
N,N-bis(ethylamino)-1-phenylmethanamine has a molecular weight of 193.29 g/mol, XLogP of 1.54, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(ethylamino)-1-phenylmethanamine is sourced from PubChem (CID 139752469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).