N-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine

C15H24N2 — CID 62436306

IUPACN-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine
SMILESCc1ccccc1N(C)CC(C)CNC1CC1
InChIInChI=1S/C15H24N2/c1-12(10-16-14-8-9-14)11-17(3)15-7-5-4-6-13(15)2/h4-7,12,14,16H,8-11H2,1-3H3
InChIKeyLKMVBRDPJBSVQG-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.82
Rot. Bonds6

About N-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine

N-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine (PubChem CID 62436306) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine.

Molecular Properties

Compound NameN-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine
PubChem CID62436306
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine
SMILESCc1ccccc1N(C)CC(C)CNC1CC1
InChIInChI=1S/C15H24N2/c1-12(10-16-14-8-9-14)11-17(3)15-7-5-4-6-13(15)2/h4-7,12,14,16H,8-11H2,1-3H3
InChIKeyLKMVBRDPJBSVQG-UHFFFAOYSA-N
XLogP2.82
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-N-ethyl-N'-methyl-N'-(2-methylphenyl)ethane-1,2-diamine
CID 104745809
N,N'-dimethyl-N-(2-methylphenyl)-2-propan-2-ylpropane-1,3-diamine
CID 115252770
N-cyclopropyl-N'-[1-(2-fluorophenyl)ethyl]-N',2-dimethylpropane-1,3-diamine
CID 62985981
N-[[5-[(cyclopropylamino)methyl]thiophen-2-yl]methyl]-N,2-dimethylaniline
CID 107556404
N-[2-methyl-3-(2-methylphenyl)butyl]cyclopropanamine
CID 81015304
1-N-cyclopropyl-2-N,3-dimethyl-2-N-[(2-methylphenyl)methyl]butane-1,2-diamine
CID 62461524
2-[(cyclopropylamino)methyl]-N-methyl-N-pentan-3-ylaniline
CID 43571414
2-(cyclopropylamino)-4-(N,2-dimethylanilino)-2-methylbutan-1-ol
CID 64789346
N-cyclopropyl-N'-(furan-2-ylmethyl)-N',2-dimethylpropane-1,3-diamine
CID 62420056
N-cyclopropyl-N'-ethyl-2-methyl-N'-(4-methylphenyl)propane-1,3-diamine
CID 62437096
ethyl 2-(cyclopropylamino)-4-(N,2-dimethylanilino)butanoate
CID 63053643
N-[2-(2-methylphenyl)-2-(2-methylpropoxy)ethyl]cyclopropanamine
CID 62105981

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine?
The IUPAC name of N-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine (CID 62436306) is N-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine.
What is the SMILES notation for N-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine?
The canonical SMILES for N-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine is Cc1ccccc1N(C)CC(C)CNC1CC1.
What is the InChIKey of N-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine?
The InChIKey is LKMVBRDPJBSVQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-12(10-16-14-8-9-14)11-17(3)15-7-5-4-6-13(15)2/h4-7,12,14,16H,8-11H2,1-3H3.
What are the key properties of N-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine?
N-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine has a molecular weight of 232.37 g/mol, XLogP of 2.82, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N',2-dimethyl-N'-(2-methylphenyl)propane-1,3-diamine is sourced from PubChem (CID 62436306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).