1-(2,4-dimethylphenyl)-N-(2-methylpropyl)ethane-1,2-diamine

C14H24N2 — CID 65385194

IUPAC1-(2,4-dimethylphenyl)-N-(2-methylpropyl)ethane-1,2-diamine
SMILESCc1ccc(C(CN)NCC(C)C)c(C)c1
InChIInChI=1S/C14H24N2/c1-10(2)9-16-14(8-15)13-6-5-11(3)7-12(13)4/h5-7,10,14,16H,8-9,15H2,1-4H3
InChIKeyOZKYWHWDAGQUJH-UHFFFAOYSA-N
MW220.36 g/mol
LogP2.55
Rot. Bonds5

About 1-(2,4-dimethylphenyl)-N-(2-methylpropyl)ethane-1,2-diamine

1-(2,4-dimethylphenyl)-N-(2-methylpropyl)ethane-1,2-diamine (PubChem CID 65385194) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 1-(2,4-dimethylphenyl)-N-(2-methylpropyl)ethane-1,2-diamine.

Molecular Properties

Compound Name1-(2,4-dimethylphenyl)-N-(2-methylpropyl)ethane-1,2-diamine
PubChem CID65385194
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name1-(2,4-dimethylphenyl)-N-(2-methylpropyl)ethane-1,2-diamine
SMILESCc1ccc(C(CN)NCC(C)C)c(C)c1
InChIInChI=1S/C14H24N2/c1-10(2)9-16-14(8-15)13-6-5-11(3)7-12(13)4/h5-7,10,14,16H,8-9,15H2,1-4H3
InChIKeyOZKYWHWDAGQUJH-UHFFFAOYSA-N
XLogP2.55
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclopropylmethyl)-1-(2,4-dimethylphenyl)ethane-1,2-diamine
CID 65384182
1-(2,4-dimethylphenyl)-2-(2-methylpropylamino)propan-1-ol
CID 82313439
N-(2,2-difluoroethyl)-1-(4-fluoro-2-methylphenyl)ethane-1,2-diamine
CID 115406339
1-(2,4-dimethylphenyl)-N-[(2,4,6-trimethylphenyl)methyl]ethanamine
CID 18767185
ethyl N-[2-amino-1-(2,4-dimethylphenyl)ethyl]carbamate
CID 24689241
2-amino-1-(2,4-dimethylphenyl)ethanol;hydrochloride
CID 137346924
5-amino-N-[1-(2,4-dimethylphenyl)ethyl]-4-methylpentanamide
CID 82011319
1-(2,4-dimethylphenyl)-5-methyl-N-propylhexan-1-amine
CID 105028958
1-(2,4-dimethylphenyl)-N-ethyl-4-methoxypentan-1-amine
CID 105145249
N-[1-(2,4-dimethylphenyl)ethyl]-2-methylpentan-1-amine
CID 63448800
N-[(1S)-1-(2,4-dimethylphenyl)ethyl]hydroxylamine
CID 130067534
1-(2,4-dimethylphenyl)-N-ethyl-2-[2-(2-methylpropoxy)ethoxy]ethanamine
CID 106447398

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethylphenyl)-N-(2-methylpropyl)ethane-1,2-diamine?
The IUPAC name of 1-(2,4-dimethylphenyl)-N-(2-methylpropyl)ethane-1,2-diamine (CID 65385194) is 1-(2,4-dimethylphenyl)-N-(2-methylpropyl)ethane-1,2-diamine.
What is the SMILES notation for 1-(2,4-dimethylphenyl)-N-(2-methylpropyl)ethane-1,2-diamine?
The canonical SMILES for 1-(2,4-dimethylphenyl)-N-(2-methylpropyl)ethane-1,2-diamine is Cc1ccc(C(CN)NCC(C)C)c(C)c1.
What is the InChIKey of 1-(2,4-dimethylphenyl)-N-(2-methylpropyl)ethane-1,2-diamine?
The InChIKey is OZKYWHWDAGQUJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-10(2)9-16-14(8-15)13-6-5-11(3)7-12(13)4/h5-7,10,14,16H,8-9,15H2,1-4H3.
What are the key properties of 1-(2,4-dimethylphenyl)-N-(2-methylpropyl)ethane-1,2-diamine?
1-(2,4-dimethylphenyl)-N-(2-methylpropyl)ethane-1,2-diamine has a molecular weight of 220.36 g/mol, XLogP of 2.55, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylphenyl)-N-(2-methylpropyl)ethane-1,2-diamine is sourced from PubChem (CID 65385194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).