3-[(3-methylphenoxy)methyl]pyridin-2-amine

C13H14N2O — CID 62465645

IUPAC3-[(3-methylphenoxy)methyl]pyridin-2-amine
SMILESCc1cccc(OCc2cccnc2N)c1
InChIInChI=1S/C13H14N2O/c1-10-4-2-6-12(8-10)16-9-11-5-3-7-15-13(11)14/h2-8H,9H2,1H3,(H2,14,15)
InChIKeyGIEBHQNHJKPPBV-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.55
Rot. Bonds3

About 3-[(3-methylphenoxy)methyl]pyridin-2-amine

3-[(3-methylphenoxy)methyl]pyridin-2-amine (PubChem CID 62465645) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 3-[(3-methylphenoxy)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[(3-methylphenoxy)methyl]pyridin-2-amine
PubChem CID62465645
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name3-[(3-methylphenoxy)methyl]pyridin-2-amine
SMILESCc1cccc(OCc2cccnc2N)c1
InChIInChI=1S/C13H14N2O/c1-10-4-2-6-12(8-10)16-9-11-5-3-7-15-13(11)14/h2-8H,9H2,1H3,(H2,14,15)
InChIKeyGIEBHQNHJKPPBV-UHFFFAOYSA-N
XLogP2.55
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2-amino-3-pyridinyl)methoxy]phenol
CID 105469612
3-[(4-methylphenoxy)methyl]pyridin-2-amine
CID 62464607
3-[(3-methylphenoxy)methyl]pyridine-2-carboximidamide
CID 62894051
1-methyl-2-[(3-methylphenoxy)methyl]benzene
CID 60627935
1-ethyl-2-[(3-methylphenoxy)methyl]benzene
CID 70995774
3-[(3-methylphenoxy)methyl]quinolin-2-amine
CID 62193527
4-[(2-amino-3-pyridinyl)methoxy]phenol
CID 105469611
1,2-dichloro-3-[(3-methylphenoxy)methyl]benzene
CID 107310396
4-[(3-methylphenoxy)methyl]aniline
CID 16789694
4-[(2-amino-3-pyridinyl)methoxy]benzonitrile
CID 62465646
3-[(5-chloro-3-pyridinyl)oxymethyl]pyridin-2-amine
CID 64600258
5-methyl-2-[(3-methylphenoxy)methyl]phenol
CID 117221129

Frequently Asked Questions

What is the IUPAC name of 3-[(3-methylphenoxy)methyl]pyridin-2-amine?
The IUPAC name of 3-[(3-methylphenoxy)methyl]pyridin-2-amine (CID 62465645) is 3-[(3-methylphenoxy)methyl]pyridin-2-amine.
What is the SMILES notation for 3-[(3-methylphenoxy)methyl]pyridin-2-amine?
The canonical SMILES for 3-[(3-methylphenoxy)methyl]pyridin-2-amine is Cc1cccc(OCc2cccnc2N)c1.
What is the InChIKey of 3-[(3-methylphenoxy)methyl]pyridin-2-amine?
The InChIKey is GIEBHQNHJKPPBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-10-4-2-6-12(8-10)16-9-11-5-3-7-15-13(11)14/h2-8H,9H2,1H3,(H2,14,15).
What are the key properties of 3-[(3-methylphenoxy)methyl]pyridin-2-amine?
3-[(3-methylphenoxy)methyl]pyridin-2-amine has a molecular weight of 214.27 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-methylphenoxy)methyl]pyridin-2-amine is sourced from PubChem (CID 62465645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).