N-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine

C13H20N2 — CID 62070851

IUPACN-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine
SMILESCCc1ccc(C(CN)NC2CC2)cc1
InChIInChI=1S/C13H20N2/c1-2-10-3-5-11(6-4-10)13(9-14)15-12-7-8-12/h3-6,12-13,15H,2,7-9,14H2,1H3
InChIKeyDAEJVNPEJOXUOW-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.00
Rot. Bonds5

About N-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine

N-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine (PubChem CID 62070851) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is N-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine
PubChem CID62070851
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC NameN-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine
SMILESCCc1ccc(C(CN)NC2CC2)cc1
InChIInChI=1S/C13H20N2/c1-2-10-3-5-11(6-4-10)13(9-14)15-12-7-8-12/h3-6,12-13,15H,2,7-9,14H2,1H3
InChIKeyDAEJVNPEJOXUOW-UHFFFAOYSA-N
XLogP2.00
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-1-(4-methoxyphenyl)ethane-1,2-diamine
CID 62070325
N-cyclopropyl-1-(4-phenylphenyl)ethane-1,2-diamine
CID 55030697
N-cycloheptyl-1-(4-ethoxyphenyl)ethane-1,2-diamine
CID 65379732
N-cyclobutyl-1-(4-methoxyphenyl)ethane-1,2-diamine
CID 105476319
1-(4-bromo-3-methylphenyl)-N-cyclopropylethane-1,2-diamine
CID 66475041
N-cyclohexyl-1-(4-methylsulfanylphenyl)ethane-1,2-diamine
CID 65384746
N-[1-(4-ethylphenyl)propyl]-3,5-dimethylcyclohexan-1-amine
CID 64732839
[2-cyclopropyl-1-(4-ethylphenyl)ethyl]hydrazine
CID 105197252
1-(4-ethylphenyl)-N-phenylethane-1,2-diamine
CID 65382327
N-cyclopentyl-1-[4-(trifluoromethoxy)phenyl]ethane-1,2-diamine
CID 65385001
N-[(1R)-1-(4-bromophenyl)propyl]cyclopropanamine
CID 30081048
N-cyclopropyl-1-(3,5-difluorophenyl)ethane-1,2-diamine
CID 106528632

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine?
The IUPAC name of N-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine (CID 62070851) is N-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine.
What is the SMILES notation for N-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine?
The canonical SMILES for N-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine is CCc1ccc(C(CN)NC2CC2)cc1.
What is the InChIKey of N-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine?
The InChIKey is DAEJVNPEJOXUOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-2-10-3-5-11(6-4-10)13(9-14)15-12-7-8-12/h3-6,12-13,15H,2,7-9,14H2,1H3.
What are the key properties of N-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine?
N-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine has a molecular weight of 204.32 g/mol, XLogP of 2.00, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(4-ethylphenyl)ethane-1,2-diamine is sourced from PubChem (CID 62070851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).