2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine

C10H14N2 — CID 43264707

IUPAC2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine
SMILESCN(c1ccccc1N)C1CC1
InChIInChI=1S/C10H14N2/c1-12(8-6-7-8)10-5-3-2-4-9(10)11/h2-5,8H,6-7,11H2,1H3
InChIKeySTLXTASSUCKLFC-UHFFFAOYSA-N
MW162.24 g/mol
LogP1.87
Rot. Bonds2

About 2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine

2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine (PubChem CID 43264707) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is 2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine.

Molecular Properties

Compound Name2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine
PubChem CID43264707
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Name2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine
SMILESCN(c1ccccc1N)C1CC1
InChIInChI=1S/C10H14N2/c1-12(8-6-7-8)10-5-3-2-4-9(10)11/h2-5,8H,6-7,11H2,1H3
InChIKeySTLXTASSUCKLFC-UHFFFAOYSA-N
XLogP1.87
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-N-cyclopentyl-2-N-methylbenzene-1,2-diamine
CID 43266943
2-N-methyl-2-N-(thian-4-yl)benzene-1,2-diamine
CID 83838961
N-cyclopropyl-2-fluoro-N-methylaniline;hydrochloride
CID 138393814
3-N,2-dimethyl-3-N-(4-methylcyclohexyl)benzene-1,3-diamine
CID 63076254
3-N-cyclopentyl-3-N,2-dimethylbenzene-1,3-diamine
CID 63077474
4-bromo-2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine
CID 65343671
4-fluoro-2-N-methyl-2-N-(4-methylcyclohexyl)benzene-1,2-diamine
CID 62376622
2-N-(2-aminophenyl)-2-N-methylbenzene-1,2-diamine
CID 86253618
2-N-(2-ethylcyclohexyl)-2-N-methylbenzene-1,2-diamine
CID 63861614
4-N-(2-tert-butylphenyl)-4-N-methylcyclohexane-1,4-diamine
CID 117029186
2-[(1S)-1-aminoethyl]-N-methyl-N-(4-methylcyclohexyl)aniline
CID 78934792
2-N-ethyl-2-N-(4-methylcyclohexyl)benzene-1,2-diamine
CID 64747727

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine?
The IUPAC name of 2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine (CID 43264707) is 2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine.
What is the SMILES notation for 2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine?
The canonical SMILES for 2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine is CN(c1ccccc1N)C1CC1.
What is the InChIKey of 2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine?
The InChIKey is STLXTASSUCKLFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c1-12(8-6-7-8)10-5-3-2-4-9(10)11/h2-5,8H,6-7,11H2,1H3.
What are the key properties of 2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine?
2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine has a molecular weight of 162.24 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopropyl-2-N-methylbenzene-1,2-diamine is sourced from PubChem (CID 43264707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).