N-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azetidin-3-amine

C14H20N2O — CID 113422694

IUPACN-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azetidin-3-amine
SMILESCC1COc2ccccc2C1N(C)C1CNC1
InChIInChI=1S/C14H20N2O/c1-10-9-17-13-6-4-3-5-12(13)14(10)16(2)11-7-15-8-11/h3-6,10-11,14-15H,7-9H2,1-2H3
InChIKeyWYHUKHMWGQSARM-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.66
Rot. Bonds2

About N-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azetidin-3-amine

N-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azetidin-3-amine (PubChem CID 113422694) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azetidin-3-amine.

Molecular Properties

Compound NameN-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azetidin-3-amine
PubChem CID113422694
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azetidin-3-amine
SMILESCC1COc2ccccc2C1N(C)C1CNC1
InChIInChI=1S/C14H20N2O/c1-10-9-17-13-6-4-3-5-12(13)14(10)16(2)11-7-15-8-11/h3-6,10-11,14-15H,7-9H2,1-2H3
InChIKeyWYHUKHMWGQSARM-UHFFFAOYSA-N
XLogP1.66
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)pyrrolidin-3-amine
CID 113422693
N-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azepan-4-amine
CID 107171928
4-[methyl-(3-methyl-3,4-dihydro-2H-chromen-4-yl)amino]oxolane-3-carboxylic acid
CID 104524841
N',2,2-trimethyl-N'-(3-methyl-3,4-dihydro-2H-chromen-4-yl)propane-1,3-diamine
CID 104524608
2-[methyl-(3-methyl-3,4-dihydro-2H-chromen-4-yl)amino]acetic acid
CID 104524795
(4S)-3-methyl-3,4-dihydro-2H-chromen-4-amine
CID 68776309
3,4-dimethyl-3,4-dihydro-2H-chromene;methanol
CID 90924294
N-ethyl-3-methyl-N-(piperidin-3-ylmethyl)-3,4-dihydro-2H-chromen-4-amine
CID 106624364
N,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine
CID 45088771
3-methyl-N-pentan-2-yl-3,4-dihydro-2H-chromen-4-amine
CID 104523746
N-(2,3-dihydro-1H-inden-2-yl)-N-methylazetidin-3-amine
CID 66185429
2-[(3-methyl-3,4-dihydro-2H-chromen-4-yl)-(2,2,2-trifluoroethyl)amino]acetic acid
CID 104524844

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azetidin-3-amine?
The IUPAC name of N-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azetidin-3-amine (CID 113422694) is N-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azetidin-3-amine.
What is the SMILES notation for N-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azetidin-3-amine?
The canonical SMILES for N-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azetidin-3-amine is CC1COc2ccccc2C1N(C)C1CNC1.
What is the InChIKey of N-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azetidin-3-amine?
The InChIKey is WYHUKHMWGQSARM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10-9-17-13-6-4-3-5-12(13)14(10)16(2)11-7-15-8-11/h3-6,10-11,14-15H,7-9H2,1-2H3.
What are the key properties of N-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azetidin-3-amine?
N-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azetidin-3-amine has a molecular weight of 232.33 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-methyl-3,4-dihydro-2H-chromen-4-yl)azetidin-3-amine is sourced from PubChem (CID 113422694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).