N-cyclopropyl-1-(2,5-dimethylphenyl)-N-ethylethane-1,2-diamine

C15H24N2 — CID 54977845

IUPACN-cyclopropyl-1-(2,5-dimethylphenyl)-N-ethylethane-1,2-diamine
SMILESCCN(C1CC1)C(CN)c1cc(C)ccc1C
InChIInChI=1S/C15H24N2/c1-4-17(13-7-8-13)15(10-16)14-9-11(2)5-6-12(14)3/h5-6,9,13,15H,4,7-8,10,16H2,1-3H3
InChIKeyOLVCEXKYDYLECF-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.79
Rot. Bonds5

About N-cyclopropyl-1-(2,5-dimethylphenyl)-N-ethylethane-1,2-diamine

N-cyclopropyl-1-(2,5-dimethylphenyl)-N-ethylethane-1,2-diamine (PubChem CID 54977845) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-cyclopropyl-1-(2,5-dimethylphenyl)-N-ethylethane-1,2-diamine.

Molecular Properties

Compound NameN-cyclopropyl-1-(2,5-dimethylphenyl)-N-ethylethane-1,2-diamine
PubChem CID54977845
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-cyclopropyl-1-(2,5-dimethylphenyl)-N-ethylethane-1,2-diamine
SMILESCCN(C1CC1)C(CN)c1cc(C)ccc1C
InChIInChI=1S/C15H24N2/c1-4-17(13-7-8-13)15(10-16)14-9-11(2)5-6-12(14)3/h5-6,9,13,15H,4,7-8,10,16H2,1-3H3
InChIKeyOLVCEXKYDYLECF-UHFFFAOYSA-N
XLogP2.79
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-N-ethyl-1-(2-fluoro-5-methylphenyl)ethane-1,2-diamine
CID 114053998
N-(cyclopropylmethyl)-1-(2,5-dimethylphenyl)-N-propan-2-ylethane-1,2-diamine
CID 55001111
N-cyclopropyl-1-(2,3-dichlorophenyl)-N-ethylethane-1,2-diamine
CID 43264069
1-(2,5-dimethylphenyl)-N-ethyl-N-(2-methylbutyl)ethane-1,2-diamine
CID 79477292
N-cyclopropyl-1-(2,5-dimethoxyphenyl)-N-ethylethane-1,2-diamine
CID 43263961
4-N-[1-(2,5-dimethylphenyl)ethyl]-4-N-propylcyclohexane-1,4-diamine
CID 79113200
N-cyclopropyl-1-[4-(difluoromethyl)phenyl]-N-ethylethane-1,2-diamine
CID 113328405
N-cyclopropyl-N-ethyl-1-(5-methylthiophen-2-yl)ethane-1,2-diamine
CID 43264016
N-cyclopropyl-1-(3,4-dimethylphenyl)-N-propylethane-1,2-diamine
CID 43753483
N-cyclopropyl-N-ethyl-1-(4-methylsulfanylphenyl)ethane-1,2-diamine
CID 43264029
1-(5-bromo-2-fluorophenyl)-N-cyclopentyl-N-ethylethane-1,2-diamine
CID 43540902
2-N-cyclopropyl-1-N-[1-(2,5-dimethylphenyl)ethyl]-2-N-methylpropane-1,2-diamine
CID 103781596

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(2,5-dimethylphenyl)-N-ethylethane-1,2-diamine?
The IUPAC name of N-cyclopropyl-1-(2,5-dimethylphenyl)-N-ethylethane-1,2-diamine (CID 54977845) is N-cyclopropyl-1-(2,5-dimethylphenyl)-N-ethylethane-1,2-diamine.
What is the SMILES notation for N-cyclopropyl-1-(2,5-dimethylphenyl)-N-ethylethane-1,2-diamine?
The canonical SMILES for N-cyclopropyl-1-(2,5-dimethylphenyl)-N-ethylethane-1,2-diamine is CCN(C1CC1)C(CN)c1cc(C)ccc1C.
What is the InChIKey of N-cyclopropyl-1-(2,5-dimethylphenyl)-N-ethylethane-1,2-diamine?
The InChIKey is OLVCEXKYDYLECF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-4-17(13-7-8-13)15(10-16)14-9-11(2)5-6-12(14)3/h5-6,9,13,15H,4,7-8,10,16H2,1-3H3.
What are the key properties of N-cyclopropyl-1-(2,5-dimethylphenyl)-N-ethylethane-1,2-diamine?
N-cyclopropyl-1-(2,5-dimethylphenyl)-N-ethylethane-1,2-diamine has a molecular weight of 232.37 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(2,5-dimethylphenyl)-N-ethylethane-1,2-diamine is sourced from PubChem (CID 54977845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).