N'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine

C17H30N2 — CID 43269507

IUPACN'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine
SMILESCCCc1ccc(C(N)CN(CCC)C(C)C)cc1
InChIInChI=1S/C17H30N2/c1-5-7-15-8-10-16(11-9-15)17(18)13-19(12-6-2)14(3)4/h8-11,14,17H,5-7,12-13,18H2,1-4H3
InChIKeyLTYPLXMBHMDMTG-UHFFFAOYSA-N
MW262.44 g/mol
LogP3.76
Rot. Bonds8

About N'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine

N'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine (PubChem CID 43269507) has the molecular formula C17H30N2 and a molecular weight of 262.44 g/mol. Its IUPAC name is N'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine
PubChem CID43269507
Molecular FormulaC17H30N2
Molecular Weight262.44 g/mol
Exact Mass262.24
IUPAC NameN'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine
SMILESCCCc1ccc(C(N)CN(CCC)C(C)C)cc1
InChIInChI=1S/C17H30N2/c1-5-7-15-8-10-16(11-9-15)17(18)13-19(12-6-2)14(3)4/h8-11,14,17H,5-7,12-13,18H2,1-4H3
InChIKeyLTYPLXMBHMDMTG-UHFFFAOYSA-N
XLogP3.76
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.44
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-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'-methyl-1-(4-propylphenyl)ethane-1,2-diamine
CID 43105672
N'-methyl-N'-(2-methylbutyl)-1-(4-propylphenyl)ethane-1,2-diamine
CID 43295696
N'-methyl-N'-(3-methylbutan-2-yl)-1-(4-propylphenyl)ethane-1,2-diamine
CID 43569993
N'-ethyl-N'-(2-methylpropyl)-1-(4-propylphenyl)ethane-1,2-diamine
CID 43273668
N'-cyclopropyl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine
CID 43270345
2-[pentyl(propan-2-yl)amino]-1-(4-propylphenyl)ethanol
CID 63472297
N'-(1-methoxypropan-2-yl)-N'-methyl-1-(4-propylphenyl)ethane-1,2-diamine
CID 61451468
(1S)-1-(4-propylphenyl)ethanamine
CID 7047688
1-(4-ethylphenyl)-N',N'-dipropylethane-1,2-diamine
CID 43094884
2-[2-methoxyethyl(propan-2-yl)amino]-1-(4-propylphenyl)ethanol
CID 82960025
N'-cyclopropyl-N'-ethyl-1-(4-propylphenyl)ethane-1,2-diamine
CID 43264141
1-(4-chlorophenyl)-N'-propan-2-yl-N'-propylpropane-1,3-diamine
CID 62644814

Frequently Asked Questions

What is the IUPAC name of N'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine?
The IUPAC name of N'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine (CID 43269507) is N'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine.
What is the SMILES notation for N'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine?
The canonical SMILES for N'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine is CCCc1ccc(C(N)CN(CCC)C(C)C)cc1.
What is the InChIKey of N'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine?
The InChIKey is LTYPLXMBHMDMTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2/c1-5-7-15-8-10-16(11-9-15)17(18)13-19(12-6-2)14(3)4/h8-11,14,17H,5-7,12-13,18H2,1-4H3.
What are the key properties of N'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine?
N'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine has a molecular weight of 262.44 g/mol, XLogP of 3.76, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine is sourced from PubChem (CID 43269507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).