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

C17H28N2 — CID 43270345

IUPACN'-cyclopropyl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine
SMILESCCCc1ccc(C(N)CN(CCC)C2CC2)cc1
InChIInChI=1S/C17H28N2/c1-3-5-14-6-8-15(9-7-14)17(18)13-19(12-4-2)16-10-11-16/h6-9,16-17H,3-5,10-13,18H2,1-2H3
InChIKeyOVTLMMDETKSEOE-UHFFFAOYSA-N
MW260.43 g/mol
LogP3.51
Rot. Bonds8

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

N'-cyclopropyl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine (PubChem CID 43270345) has the molecular formula C17H28N2 and a molecular weight of 260.43 g/mol. Its IUPAC name is N'-cyclopropyl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine
PubChem CID43270345
Molecular FormulaC17H28N2
Molecular Weight260.43 g/mol
Exact Mass260.23
IUPAC NameN'-cyclopropyl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine
SMILESCCCc1ccc(C(N)CN(CCC)C2CC2)cc1
InChIInChI=1S/C17H28N2/c1-3-5-14-6-8-15(9-7-14)17(18)13-19(12-4-2)16-10-11-16/h6-9,16-17H,3-5,10-13,18H2,1-2H3
InChIKeyOVTLMMDETKSEOE-UHFFFAOYSA-N
XLogP3.51
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.43
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-cyclopropyl-N'-ethyl-1-(4-propylphenyl)ethane-1,2-diamine
CID 43264141
N'-cyclopentyl-N'-ethyl-1-(4-propylphenyl)ethane-1,2-diamine
CID 43541052
N'-butyl-N'-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine
CID 61441578
N'-cyclohexyl-N'-methyl-1-(4-propylphenyl)ethane-1,2-diamine
CID 43099891
N'-propan-2-yl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine
CID 43269507
1-(4-ethylphenyl)-N'-methyl-N'-(4-methylcyclohexyl)ethane-1,2-diamine
CID 61437159
N'-methyl-N'-(3-methylbutan-2-yl)-1-(4-propylphenyl)ethane-1,2-diamine
CID 43569993
N'-butyl-N'-methyl-1-(4-propylphenyl)ethane-1,2-diamine
CID 43105672
1-(4-bromophenyl)-N'-cyclopropyl-N'-propylpropane-1,3-diamine
CID 62617872
N'-cyclopropyl-1-(2,4-dimethylphenyl)-N'-propylethane-1,2-diamine
CID 43270354
N'-methyl-N'-(2-methylbutyl)-1-(4-propylphenyl)ethane-1,2-diamine
CID 43295696
N'-ethyl-N'-(2-methylpropyl)-1-(4-propylphenyl)ethane-1,2-diamine
CID 43273668

Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine?
The IUPAC name of N'-cyclopropyl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine (CID 43270345) is N'-cyclopropyl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine.
What is the SMILES notation for N'-cyclopropyl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine?
The canonical SMILES for N'-cyclopropyl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine is CCCc1ccc(C(N)CN(CCC)C2CC2)cc1.
What is the InChIKey of N'-cyclopropyl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine?
The InChIKey is OVTLMMDETKSEOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-3-5-14-6-8-15(9-7-14)17(18)13-19(12-4-2)16-10-11-16/h6-9,16-17H,3-5,10-13,18H2,1-2H3.
What are the key properties of N'-cyclopropyl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine?
N'-cyclopropyl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine has a molecular weight of 260.43 g/mol, XLogP of 3.51, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-N'-propyl-1-(4-propylphenyl)ethane-1,2-diamine is sourced from PubChem (CID 43270345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).