N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline

C18H30N2 — CID 79867078

IUPACN-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline
SMILESCCN(CC1CCC(C)(C)C1NC)c1cccc(C)c1
InChIInChI=1S/C18H30N2/c1-6-20(16-9-7-8-14(2)12-16)13-15-10-11-18(3,4)17(15)19-5/h7-9,12,15,17,19H,6,10-11,13H2,1-5H3
InChIKeyZTUDKOXJUXZGBO-UHFFFAOYSA-N
MW274.45 g/mol
LogP3.85
Rot. Bonds5

About N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline

N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline (PubChem CID 79867078) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline.

Molecular Properties

Compound NameN-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline
PubChem CID79867078
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC NameN-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline
SMILESCCN(CC1CCC(C)(C)C1NC)c1cccc(C)c1
InChIInChI=1S/C18H30N2/c1-6-20(16-9-7-8-14(2)12-16)13-15-10-11-18(3,4)17(15)19-5/h7-9,12,15,17,19H,6,10-11,13H2,1-5H3
InChIKeyZTUDKOXJUXZGBO-UHFFFAOYSA-N
XLogP3.85
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline 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-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethylaniline
CID 79865267
N-[[3,3-dimethyl-2-(methylamino)cyclohexyl]methyl]-N-ethyl-3-fluoroaniline
CID 79842644
N-[(2-amino-5-methylcyclohexyl)methyl]-N-ethyl-3-methylaniline
CID 63495505
5-[[(3-fluorophenyl)methyl-methylamino]methyl]-N,2,2-trimethylcyclopentan-1-amine
CID 79866448
N-ethyl-3-methyl-N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]aniline
CID 55073617
N,2,2-trimethyl-5-[[methyl(2-phenylethyl)amino]methyl]cyclopentan-1-amine
CID 79855039
N-ethyl-3-methyl-N-[2-[1-(methylamino)cyclohexyl]ethyl]aniline
CID 65241281
2-[(N-ethyl-3-methylanilino)methyl]cyclohexan-1-one
CID 62614567
N,N'-diethyl-N,N'-bis(3-methylphenyl)propane-1,3-diamine
CID 57172568
1-[(N-ethyl-3-methylanilino)methyl]cyclopentane-1-carbaldehyde
CID 62276974
N-(cyclopropylmethyl)-N'-ethyl-N'-(3-methylphenyl)ethane-1,2-diamine
CID 61077282
1-[(N-ethyl-3-methylanilino)methyl]cyclopropane-1-carbonitrile
CID 82113622

Frequently Asked Questions

What is the IUPAC name of N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline?
The IUPAC name of N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline (CID 79867078) is N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline.
What is the SMILES notation for N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline?
The canonical SMILES for N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline is CCN(CC1CCC(C)(C)C1NC)c1cccc(C)c1.
What is the InChIKey of N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline?
The InChIKey is ZTUDKOXJUXZGBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2/c1-6-20(16-9-7-8-14(2)12-16)13-15-10-11-18(3,4)17(15)19-5/h7-9,12,15,17,19H,6,10-11,13H2,1-5H3.
What are the key properties of N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline?
N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline has a molecular weight of 274.45 g/mol, XLogP of 3.85, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-ethyl-3-methylaniline is sourced from PubChem (CID 79867078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).