N-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine

C13H20N2 — CID 117027081

IUPACN-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine
SMILESCc1cccc(C(C)C)c1NC1CNC1
InChIInChI=1S/C13H20N2/c1-9(2)12-6-4-5-10(3)13(12)15-11-7-14-8-11/h4-6,9,11,14-15H,7-8H2,1-3H3
InChIKeySYRMBINMKIKCFM-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.50
Rot. Bonds3

About N-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine

N-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine (PubChem CID 117027081) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is N-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine.

Molecular Properties

Compound NameN-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine
PubChem CID117027081
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC NameN-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine
SMILESCc1cccc(C(C)C)c1NC1CNC1
InChIInChI=1S/C13H20N2/c1-9(2)12-6-4-5-10(3)13(12)15-11-7-14-8-11/h4-6,9,11,14-15H,7-8H2,1-3H3
InChIKeySYRMBINMKIKCFM-UHFFFAOYSA-N
XLogP2.50
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-(piperidin-3-ylmethyl)-6-propan-2-ylaniline
CID 82086323
N-(2-methyl-6-propan-2-ylphenyl)piperazine-2-carboxamide
CID 63104160
N-(2-methyl-6-propan-2-ylphenyl)piperidine-3-carboxamide;hydrochloride
CID 119263416
4-[(2-methyl-6-propan-2-ylphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 120672180
N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 729062
3-methyl-2-N-(1-methylazetidin-3-yl)benzene-1,2-diamine
CID 130631034
1-N-(2-methyl-6-propan-2-ylphenyl)-2-N-propylcyclopropane-1,2-dicarboxamide
CID 109130528
N-(2-methyl-6-propan-2-ylphenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 24804885
6-(cyclopropylamino)-2-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrimidine-4-carboxamide
CID 109360875
N-(2-methyl-6-propan-2-ylphenyl)-2-sulfanylacetamide
CID 715390
1-(2,3-dihydro-1H-inden-2-yl)-3-(2-methyl-6-propan-2-ylphenyl)urea
CID 5008117
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CID 10730082

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine?
The IUPAC name of N-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine (CID 117027081) is N-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine.
What is the SMILES notation for N-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine?
The canonical SMILES for N-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine is Cc1cccc(C(C)C)c1NC1CNC1.
What is the InChIKey of N-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine?
The InChIKey is SYRMBINMKIKCFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-9(2)12-6-4-5-10(3)13(12)15-11-7-14-8-11/h4-6,9,11,14-15H,7-8H2,1-3H3.
What are the key properties of N-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine?
N-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine has a molecular weight of 204.32 g/mol, XLogP of 2.50, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-6-propan-2-ylphenyl)azetidin-3-amine is sourced from PubChem (CID 117027081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).