1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine

C16H20N2O — CID 112615409

IUPAC1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine
SMILESCc1cccc(CC(C)N)c1OCc1ccccn1
InChIInChI=1S/C16H20N2O/c1-12-6-5-7-14(10-13(2)17)16(12)19-11-15-8-3-4-9-18-15/h3-9,13H,10-11,17H2,1-2H3
InChIKeyFETCSSRTNODXQS-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.86
Rot. Bonds5

About 1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine

1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine (PubChem CID 112615409) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine.

Molecular Properties

Compound Name1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine
PubChem CID112615409
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine
SMILESCc1cccc(CC(C)N)c1OCc1ccccn1
InChIInChI=1S/C16H20N2O/c1-12-6-5-7-14(10-13(2)17)16(12)19-11-15-8-3-4-9-18-15/h3-9,13H,10-11,17H2,1-2H3
InChIKeyFETCSSRTNODXQS-UHFFFAOYSA-N
XLogP2.86
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[3-methyl-2-(1,2-oxazol-5-ylmethoxy)phenyl]propan-2-amine
CID 112615436
1-(3-methyl-2-pentoxyphenyl)propan-2-amine
CID 112615361
1-[2-[(2,3-difluorophenyl)methoxy]-3-methylphenyl]propan-2-amine
CID 115958090
1-[3-methyl-2-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]propan-2-amine
CID 115958083
1-(2-methoxy-3-methylphenyl)propan-2-amine
CID 3029797
1-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3-methylphenyl]propan-2-amine
CID 115958074
1-[3-bromo-2-[(3-methyl-2-pyridinyl)methoxy]phenyl]propan-2-amine
CID 115982350
1-[3-methoxy-2-[(6-methyl-2-pyridinyl)methoxy]phenyl]propan-2-amine
CID 79263428
(2S)-1-pyridin-2-ylpropan-2-amine
CID 42037572
1-[2-[(3-chlorophenyl)methoxy]-3-methylphenyl]propan-2-amine
CID 115958087
1-[3-methyl-2-(3-phenylpropoxy)phenyl]propan-2-amine
CID 115958003
1-[2-[(4-bromothiophen-2-yl)methoxy]-3-methylphenyl]propan-2-amine
CID 112615348

Frequently Asked Questions

What is the IUPAC name of 1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine?
The IUPAC name of 1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine (CID 112615409) is 1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine.
What is the SMILES notation for 1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine?
The canonical SMILES for 1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine is Cc1cccc(CC(C)N)c1OCc1ccccn1.
What is the InChIKey of 1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine?
The InChIKey is FETCSSRTNODXQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-12-6-5-7-14(10-13(2)17)16(12)19-11-15-8-3-4-9-18-15/h3-9,13H,10-11,17H2,1-2H3.
What are the key properties of 1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine?
1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine has a molecular weight of 256.35 g/mol, XLogP of 2.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-methyl-2-(pyridin-2-ylmethoxy)phenyl]propan-2-amine is sourced from PubChem (CID 112615409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).