N-(methylideneamino)-4-propan-2-ylaniline

C10H14N2 — CID 147987103

IUPACN-(methylideneamino)-4-propan-2-ylaniline
SMILESC=NNc1ccc(C(C)C)cc1
InChIInChI=1S/C10H14N2/c1-8(2)9-4-6-10(7-5-9)12-11-3/h4-8,12H,3H2,1-2H3
InChIKeyIUINJXPQSVUOLJ-UHFFFAOYSA-N
MW162.24 g/mol
LogP2.84
Rot. Bonds3

About N-(methylideneamino)-4-propan-2-ylaniline

N-(methylideneamino)-4-propan-2-ylaniline (PubChem CID 147987103) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is N-(methylideneamino)-4-propan-2-ylaniline.

Molecular Properties

Compound NameN-(methylideneamino)-4-propan-2-ylaniline
PubChem CID147987103
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC NameN-(methylideneamino)-4-propan-2-ylaniline
SMILESC=NNc1ccc(C(C)C)cc1
InChIInChI=1S/C10H14N2/c1-8(2)9-4-6-10(7-5-9)12-11-3/h4-8,12H,3H2,1-2H3
InChIKeyIUINJXPQSVUOLJ-UHFFFAOYSA-N
XLogP2.84
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-N,4-N-bis(4-propan-2-ylphenyl)benzene-1,4-diamine
CID 71359938
(4-propan-2-ylphenyl)hydrazine
CID 2733249
4-methyl-N-[1-(4-propan-2-ylphenyl)ethyl]aniline
CID 43093665
(4-propan-2-ylphenyl)hydrazine;hydrate;hydrochloride
CID 18702305
tris(1-methyl-4-propan-2-ylbenzene);dihydrochloride
CID 175503400
3,5-di(propan-2-yl)-N-(4-propan-2-ylphenyl)aniline
CID 177290097
CID 59694605
CID 59694605
(4-propan-2-ylphenyl)cyanamide
CID 18783174
4-(4-propan-2-ylanilino)phenol
CID 21326552
1-methyl-4-propan-2-ylbenzene;ruthenium;dihydroiodide
CID 175953909
1-methyl-4-propan-2-ylbenzene;ruthenium(2+);dichloride
CID 11551268
1-methyl-4-propan-2-ylbenzene;ruthenium(3+);triiodide
CID 175881712

Frequently Asked Questions

What is the IUPAC name of N-(methylideneamino)-4-propan-2-ylaniline?
The IUPAC name of N-(methylideneamino)-4-propan-2-ylaniline (CID 147987103) is N-(methylideneamino)-4-propan-2-ylaniline.
What is the SMILES notation for N-(methylideneamino)-4-propan-2-ylaniline?
The canonical SMILES for N-(methylideneamino)-4-propan-2-ylaniline is C=NNc1ccc(C(C)C)cc1.
What is the InChIKey of N-(methylideneamino)-4-propan-2-ylaniline?
The InChIKey is IUINJXPQSVUOLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2/c1-8(2)9-4-6-10(7-5-9)12-11-3/h4-8,12H,3H2,1-2H3.
What are the key properties of N-(methylideneamino)-4-propan-2-ylaniline?
N-(methylideneamino)-4-propan-2-ylaniline has a molecular weight of 162.24 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(methylideneamino)-4-propan-2-ylaniline is sourced from PubChem (CID 147987103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).