N-(1-cyclopropylethyl)-2,3-dimethylaniline

C13H19N — CID 43196438

IUPACN-(1-cyclopropylethyl)-2,3-dimethylaniline
SMILESCc1cccc(NC(C)C2CC2)c1C
InChIInChI=1S/C13H19N/c1-9-5-4-6-13(10(9)2)14-11(3)12-7-8-12/h4-6,11-12,14H,7-8H2,1-3H3
InChIKeyQLVBLXDLPOWIBS-UHFFFAOYSA-N
MW189.30 g/mol
LogP3.51
Rot. Bonds3

About N-(1-cyclopropylethyl)-2,3-dimethylaniline

N-(1-cyclopropylethyl)-2,3-dimethylaniline (PubChem CID 43196438) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-2,3-dimethylaniline.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-2,3-dimethylaniline
PubChem CID43196438
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC NameN-(1-cyclopropylethyl)-2,3-dimethylaniline
SMILESCc1cccc(NC(C)C2CC2)c1C
InChIInChI=1S/C13H19N/c1-9-5-4-6-13(10(9)2)14-11(3)12-7-8-12/h4-6,11-12,14H,7-8H2,1-3H3
InChIKeyQLVBLXDLPOWIBS-UHFFFAOYSA-N
XLogP3.51
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-chloro-N-(1-cyclopropylethyl)-2-methylaniline
CID 43192017
3-(1-cyclopropylethylamino)-N,2-dimethylbenzamide
CID 43734592
2,3-dimethyl-N-[1-(1-propylpiperidin-3-yl)ethyl]aniline
CID 43308056
2-methyl-N-[1-(oxan-4-yl)ethyl]aniline
CID 115916403
N-(1-cyclopropylethyl)-3-methoxy-2,4-dimethylaniline
CID 43739059
3-(1-cyclopentylethylamino)-2-methylbenzenesulfonamide
CID 62631758
N-(1-cyclopropylethyl)-2-propan-2-ylaniline
CID 43192462
N-(1-cyclopropylethyl)-2-fluoroaniline
CID 43194895
2-bromo-3-chloro-N-(1-cyclopropylethyl)aniline
CID 103477842
N-(1-cyclopropylethyl)-2-(methoxymethyl)aniline
CID 43677996
2-(2,3-dimethylanilino)propan-1-ol
CID 21221760
N-(1-cyclopropylethyl)quinolin-8-amine
CID 43191657

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-2,3-dimethylaniline?
The IUPAC name of N-(1-cyclopropylethyl)-2,3-dimethylaniline (CID 43196438) is N-(1-cyclopropylethyl)-2,3-dimethylaniline.
What is the SMILES notation for N-(1-cyclopropylethyl)-2,3-dimethylaniline?
The canonical SMILES for N-(1-cyclopropylethyl)-2,3-dimethylaniline is Cc1cccc(NC(C)C2CC2)c1C.
What is the InChIKey of N-(1-cyclopropylethyl)-2,3-dimethylaniline?
The InChIKey is QLVBLXDLPOWIBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c1-9-5-4-6-13(10(9)2)14-11(3)12-7-8-12/h4-6,11-12,14H,7-8H2,1-3H3.
What are the key properties of N-(1-cyclopropylethyl)-2,3-dimethylaniline?
N-(1-cyclopropylethyl)-2,3-dimethylaniline has a molecular weight of 189.30 g/mol, XLogP of 3.51, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-2,3-dimethylaniline is sourced from PubChem (CID 43196438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).