N'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine

C19H32N2 — CID 63466998

IUPACN'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine
SMILESCCCNC(CN(CCC)C1CC1)c1ccc(C)c(C)c1
InChIInChI=1S/C19H32N2/c1-5-11-20-19(14-21(12-6-2)18-9-10-18)17-8-7-15(3)16(4)13-17/h7-8,13,18-20H,5-6,9-12,14H2,1-4H3
InChIKeyMOZOLIRAQXWNQU-UHFFFAOYSA-N
MW288.48 g/mol
LogP4.22
Rot. Bonds9

About N'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine

N'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine (PubChem CID 63466998) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is N'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine
PubChem CID63466998
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC NameN'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine
SMILESCCCNC(CN(CCC)C1CC1)c1ccc(C)c(C)c1
InChIInChI=1S/C19H32N2/c1-5-11-20-19(14-21(12-6-2)18-9-10-18)17-8-7-15(3)16(4)13-17/h7-8,13,18-20H,5-6,9-12,14H2,1-4H3
InChIKeyMOZOLIRAQXWNQU-UHFFFAOYSA-N
XLogP4.22
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.48
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-butyl-N'-cyclopropyl-1-(4-methylphenyl)-N-propylethane-1,2-diamine
CID 63470309
N'-cyclopropyl-1-(4-methylphenyl)-N,N'-dipropylpropane-1,3-diamine
CID 63484007
N-[2-cyclohexyl-1-(3,4-dimethylphenyl)ethyl]propan-1-amine
CID 43493979
1-(3,4-dimethylphenyl)-4-methyl-N-propylpentan-1-amine
CID 43493981
N'-cyclohexyl-N'-ethyl-1-phenyl-N-propylethane-1,2-diamine
CID 63466722
N-[1-(3,4-dimethylphenyl)-2-(oxan-4-yl)ethyl]propan-1-amine
CID 115846940
N-[1-(3,4-dimethylphenyl)-2-(3-methylbutylsulfanyl)ethyl]propan-1-amine
CID 107763957
N-cyclopropyl-1-(3,4-dimethylphenyl)-N-propylethane-1,2-diamine
CID 43753483
N-[1-(3,4-dimethylphenyl)-2-propylsulfonylethyl]propan-1-amine
CID 64646093
1-(3,4-dimethylphenyl)-3-(oxolan-2-yl)-N-propylpropan-1-amine
CID 65156280
1-(3,4-dimethylphenyl)-3-methyl-N-propylbut-3-en-1-amine
CID 105004182
1-(3,4-dimethylphenyl)-4-ethoxy-N-propylbutan-1-amine
CID 105140388

Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine?
The IUPAC name of N'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine (CID 63466998) is N'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine.
What is the SMILES notation for N'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine?
The canonical SMILES for N'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine is CCCNC(CN(CCC)C1CC1)c1ccc(C)c(C)c1.
What is the InChIKey of N'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine?
The InChIKey is MOZOLIRAQXWNQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-5-11-20-19(14-21(12-6-2)18-9-10-18)17-8-7-15(3)16(4)13-17/h7-8,13,18-20H,5-6,9-12,14H2,1-4H3.
What are the key properties of N'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine?
N'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine has a molecular weight of 288.48 g/mol, XLogP of 4.22, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-1-(3,4-dimethylphenyl)-N,N'-dipropylethane-1,2-diamine is sourced from PubChem (CID 63466998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).