3-[(4-methylphenoxy)methyl]pyridin-2-amine

C13H14N2O — CID 62464607

IUPAC3-[(4-methylphenoxy)methyl]pyridin-2-amine
SMILESCc1ccc(OCc2cccnc2N)cc1
InChIInChI=1S/C13H14N2O/c1-10-4-6-12(7-5-10)16-9-11-3-2-8-15-13(11)14/h2-8H,9H2,1H3,(H2,14,15)
InChIKeyLFNVPVISPDLIOI-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.55
Rot. Bonds3

About 3-[(4-methylphenoxy)methyl]pyridin-2-amine

3-[(4-methylphenoxy)methyl]pyridin-2-amine (PubChem CID 62464607) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 3-[(4-methylphenoxy)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3-[(4-methylphenoxy)methyl]pyridin-2-amine
PubChem CID62464607
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name3-[(4-methylphenoxy)methyl]pyridin-2-amine
SMILESCc1ccc(OCc2cccnc2N)cc1
InChIInChI=1S/C13H14N2O/c1-10-4-6-12(7-5-10)16-9-11-3-2-8-15-13(11)14/h2-8H,9H2,1H3,(H2,14,15)
InChIKeyLFNVPVISPDLIOI-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

4-[(2-amino-3-pyridinyl)methoxy]phenol
CID 105469611
[3-[(4-methylphenoxy)methyl]-2-pyridinyl]methanamine
CID 62893839
3-[(3-methylphenoxy)methyl]pyridin-2-amine
CID 62465645
4-[(2-amino-3-pyridinyl)methoxy]benzonitrile
CID 62465646
[2-[(4-methylphenoxy)methyl]-3-pyridinyl]methanamine
CID 105485819
3-[(2-amino-3-pyridinyl)methoxy]phenol
CID 105469612
3-[(5-chloro-3-pyridinyl)oxymethyl]pyridin-2-amine
CID 64600258
2-[(2-amino-3-pyridinyl)methoxy]phenol
CID 105469613
(2-amino-3-pyridinyl)methyl formate
CID 174668609
3-[(2-fluorophenoxy)methyl]pyridin-2-amine
CID 62464415
2-amino-N-[[4-[(4-methylphenyl)methoxy]phenyl]methyl]pyridine-3-carboxamide
CID 66844013
3-[(2-methyl-5-propan-2-ylphenoxy)methyl]pyridin-2-amine
CID 55076540

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methylphenoxy)methyl]pyridin-2-amine?
The IUPAC name of 3-[(4-methylphenoxy)methyl]pyridin-2-amine (CID 62464607) is 3-[(4-methylphenoxy)methyl]pyridin-2-amine.
What is the SMILES notation for 3-[(4-methylphenoxy)methyl]pyridin-2-amine?
The canonical SMILES for 3-[(4-methylphenoxy)methyl]pyridin-2-amine is Cc1ccc(OCc2cccnc2N)cc1.
What is the InChIKey of 3-[(4-methylphenoxy)methyl]pyridin-2-amine?
The InChIKey is LFNVPVISPDLIOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-10-4-6-12(7-5-10)16-9-11-3-2-8-15-13(11)14/h2-8H,9H2,1H3,(H2,14,15).
What are the key properties of 3-[(4-methylphenoxy)methyl]pyridin-2-amine?
3-[(4-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-[(4-methylphenoxy)methyl]pyridin-2-amine is sourced from PubChem (CID 62464607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).