N-cyclopropyl-1-(2,5-dimethylphenyl)ethane-1,2-diamine

C13H20N2 — CID 62070690

IUPACN-cyclopropyl-1-(2,5-dimethylphenyl)ethane-1,2-diamine
SMILESCc1ccc(C)c(C(CN)NC2CC2)c1
InChIInChI=1S/C13H20N2/c1-9-3-4-10(2)12(7-9)13(8-14)15-11-5-6-11/h3-4,7,11,13,15H,5-6,8,14H2,1-2H3
InChIKeyJKHGZGYMESECOO-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.06
Rot. Bonds4

About N-cyclopropyl-1-(2,5-dimethylphenyl)ethane-1,2-diamine

N-cyclopropyl-1-(2,5-dimethylphenyl)ethane-1,2-diamine (PubChem CID 62070690) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is N-cyclopropyl-1-(2,5-dimethylphenyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-cyclopropyl-1-(2,5-dimethylphenyl)ethane-1,2-diamine
PubChem CID62070690
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC NameN-cyclopropyl-1-(2,5-dimethylphenyl)ethane-1,2-diamine
SMILESCc1ccc(C)c(C(CN)NC2CC2)c1
InChIInChI=1S/C13H20N2/c1-9-3-4-10(2)12(7-9)13(8-14)15-11-5-6-11/h3-4,7,11,13,15H,5-6,8,14H2,1-2H3
InChIKeyJKHGZGYMESECOO-UHFFFAOYSA-N
XLogP2.06
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,3-dimethylcyclopentyl)-1-(2,5-dimethylphenyl)ethane-1,2-diamine
CID 114544940
2-(cyclopentylamino)-2-(2,5-dimethylphenyl)ethanol
CID 54977603
[2-[[2-amino-1-(2,5-dimethylphenyl)ethyl]amino]cyclopentyl]methanol
CID 106360163
1-(4-bromo-3-methylphenyl)-N-cyclopropylethane-1,2-diamine
CID 66475041
N-cyclopentyl-1-(2,3-dimethylphenyl)ethane-1,2-diamine
CID 65382887
1-(2,5-dimethylphenyl)-N-(4-methoxyphenyl)ethane-1,2-diamine
CID 65384942
N-cyclopentyl-1-(3-fluoro-4-methylphenyl)ethane-1,2-diamine
CID 65383732
1-(3-bromo-4-methylphenyl)-N-cyclopentylethane-1,2-diamine
CID 105405049
1-(2,5-dimethylphenyl)-N-methylpropan-1-amine
CID 43483756
5-amino-N-cyclopropyl-2-(2,5-dimethylphenyl)pentanamide
CID 112516850
1-(2,5-dimethylphenyl)-N-methyl-2-(oxolan-3-yl)ethanamine
CID 113362110
2-cyclopropyl-1-(2,5-dimethylphenyl)propan-1-amine
CID 83154374

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(2,5-dimethylphenyl)ethane-1,2-diamine?
The IUPAC name of N-cyclopropyl-1-(2,5-dimethylphenyl)ethane-1,2-diamine (CID 62070690) is N-cyclopropyl-1-(2,5-dimethylphenyl)ethane-1,2-diamine.
What is the SMILES notation for N-cyclopropyl-1-(2,5-dimethylphenyl)ethane-1,2-diamine?
The canonical SMILES for N-cyclopropyl-1-(2,5-dimethylphenyl)ethane-1,2-diamine is Cc1ccc(C)c(C(CN)NC2CC2)c1.
What is the InChIKey of N-cyclopropyl-1-(2,5-dimethylphenyl)ethane-1,2-diamine?
The InChIKey is JKHGZGYMESECOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-9-3-4-10(2)12(7-9)13(8-14)15-11-5-6-11/h3-4,7,11,13,15H,5-6,8,14H2,1-2H3.
What are the key properties of N-cyclopropyl-1-(2,5-dimethylphenyl)ethane-1,2-diamine?
N-cyclopropyl-1-(2,5-dimethylphenyl)ethane-1,2-diamine has a molecular weight of 204.32 g/mol, XLogP of 2.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(2,5-dimethylphenyl)ethane-1,2-diamine is sourced from PubChem (CID 62070690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).