N'-(1-cyclopropylethyl)-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine

C15H24N2 — CID 61309492

IUPACN'-(1-cyclopropylethyl)-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine
SMILESCc1cccc(C(N)CN(C)C(C)C2CC2)c1
InChIInChI=1S/C15H24N2/c1-11-5-4-6-14(9-11)15(16)10-17(3)12(2)13-7-8-13/h4-6,9,12-13,15H,7-8,10,16H2,1-3H3
InChIKeyGGYIQCWTMPZKSI-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.73
Rot. Bonds5

About N'-(1-cyclopropylethyl)-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine

N'-(1-cyclopropylethyl)-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine (PubChem CID 61309492) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N'-(1-cyclopropylethyl)-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(1-cyclopropylethyl)-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine
PubChem CID61309492
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN'-(1-cyclopropylethyl)-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine
SMILESCc1cccc(C(N)CN(C)C(C)C2CC2)c1
InChIInChI=1S/C15H24N2/c1-11-5-4-6-14(9-11)15(16)10-17(3)12(2)13-7-8-13/h4-6,9,12-13,15H,7-8,10,16H2,1-3H3
InChIKeyGGYIQCWTMPZKSI-UHFFFAOYSA-N
XLogP2.73
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 ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-cyclohexyl-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine
CID 61308548
N'-(1-cyclopropylethyl)-N'-methyl-1-(2-methylphenyl)ethane-1,2-diamine
CID 43569043
N'-methyl-N'-(2-methylbutyl)-1-(3-methylphenyl)ethane-1,2-diamine
CID 61308743
N'-(1-cyclopropylethyl)-N'-methyl-1-[4-(trifluoromethyl)phenyl]ethane-1,2-diamine
CID 107519718
1-(3-chlorophenyl)-N'-(1-cyclopropylethyl)-N'-methylpropane-1,3-diamine
CID 55098457
N'-methyl-1-(3-methylphenyl)-N'-(oxolan-3-yl)ethane-1,2-diamine
CID 82735457
1-(3-bromophenyl)-N'-(1-cyclopropylethyl)-N'-methylpropane-1,3-diamine
CID 62618564
N'-cyclopentyl-N'-ethyl-1-(3-methylphenyl)ethane-1,2-diamine
CID 61308928
N'-methyl-1-(3-methylphenyl)-N'-propylethane-1,2-diamine
CID 61308176
(S)-cyclopropyl-(3-methylphenyl)methanamine;hydrochloride
CID 171229489
N'-butan-2-yl-N'-ethyl-1-(3-methylphenyl)ethane-1,2-diamine
CID 61308741
N'-(1-cyclopropylethyl)-1-(2,5-difluorophenyl)-N'-methylethane-1,2-diamine
CID 107519713

Frequently Asked Questions

What is the IUPAC name of N'-(1-cyclopropylethyl)-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine?
The IUPAC name of N'-(1-cyclopropylethyl)-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine (CID 61309492) is N'-(1-cyclopropylethyl)-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine.
What is the SMILES notation for N'-(1-cyclopropylethyl)-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine?
The canonical SMILES for N'-(1-cyclopropylethyl)-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine is Cc1cccc(C(N)CN(C)C(C)C2CC2)c1.
What is the InChIKey of N'-(1-cyclopropylethyl)-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine?
The InChIKey is GGYIQCWTMPZKSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-11-5-4-6-14(9-11)15(16)10-17(3)12(2)13-7-8-13/h4-6,9,12-13,15H,7-8,10,16H2,1-3H3.
What are the key properties of N'-(1-cyclopropylethyl)-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine?
N'-(1-cyclopropylethyl)-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine has a molecular weight of 232.37 g/mol, XLogP of 2.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-cyclopropylethyl)-N'-methyl-1-(3-methylphenyl)ethane-1,2-diamine is sourced from PubChem (CID 61309492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).