N,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline

C16H26N2 — CID 62609293

IUPACN,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline
SMILESCNC1CCCC1CN(C)c1ccc(C)cc1C
InChIInChI=1S/C16H26N2/c1-12-8-9-16(13(2)10-12)18(4)11-14-6-5-7-15(14)17-3/h8-10,14-15,17H,5-7,11H2,1-4H3
InChIKeyUOZQEGZINYRFPU-UHFFFAOYSA-N
MW246.40 g/mol
LogP3.13
Rot. Bonds4

About N,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline

N,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline (PubChem CID 62609293) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is N,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline.

Molecular Properties

Compound NameN,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline
PubChem CID62609293
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC NameN,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline
SMILESCNC1CCCC1CN(C)c1ccc(C)cc1C
InChIInChI=1S/C16H26N2/c1-12-8-9-16(13(2)10-12)18(4)11-14-6-5-7-15(14)17-3/h8-10,14-15,17H,5-7,11H2,1-4H3
InChIKeyUOZQEGZINYRFPU-UHFFFAOYSA-N
XLogP3.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline?
The IUPAC name of N,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline (CID 62609293) is N,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline.
What is the SMILES notation for N,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline?
The canonical SMILES for N,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline is CNC1CCCC1CN(C)c1ccc(C)cc1C.
What is the InChIKey of N,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline?
The InChIKey is UOZQEGZINYRFPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-12-8-9-16(13(2)10-12)18(4)11-14-6-5-7-15(14)17-3/h8-10,14-15,17H,5-7,11H2,1-4H3.
What are the key properties of N,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline?
N,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline has a molecular weight of 246.40 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,4-trimethyl-N-[[2-(methylamino)cyclopentyl]methyl]aniline is sourced from PubChem (CID 62609293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).