N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-methyloxan-3-amine

C14H22N2O2 — CID 113354519

IUPACN-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-methyloxan-3-amine
SMILESCOc1cc(C)nc(CNC2(C)CCCOC2)c1
InChIInChI=1S/C14H22N2O2/c1-11-7-13(17-3)8-12(16-11)9-15-14(2)5-4-6-18-10-14/h7-8,15H,4-6,9-10H2,1-3H3
InChIKeyLRNRZEKQULUOFH-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.06
Rot. Bonds4

About N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-methyloxan-3-amine

N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-methyloxan-3-amine (PubChem CID 113354519) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-methyloxan-3-amine.

Molecular Properties

Compound NameN-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-methyloxan-3-amine
PubChem CID113354519
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC NameN-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-methyloxan-3-amine
SMILESCOc1cc(C)nc(CNC2(C)CCCOC2)c1
InChIInChI=1S/C14H22N2O2/c1-11-7-13(17-3)8-12(16-11)9-15-14(2)5-4-6-18-10-14/h7-8,15H,4-6,9-10H2,1-3H3
InChIKeyLRNRZEKQULUOFH-UHFFFAOYSA-N
XLogP2.06
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-1-methylcyclopentan-1-amine
CID 82892831
N-[(6-methoxy-2-pyridinyl)methyl]-3-methyloxan-3-amine
CID 103527612
1-(4-methoxy-6-methyl-2-pyridinyl)-N-[(1-methylcyclobutyl)methyl]methanamine
CID 103933097
N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-1-(trifluoromethyl)cyclopropan-1-amine
CID 114158904
[1-[[(4-methoxy-6-methyl-2-pyridinyl)methylamino]methyl]cyclopentyl]methanol
CID 82893618
N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]oxetan-3-amine
CID 82893078
[1-[[(4-methoxy-6-methyl-2-pyridinyl)methylamino]methyl]cyclohexyl]methanol
CID 115924168
N-[(2-bromo-4,5-dimethoxyphenyl)methyl]-3-methyloxan-3-amine
CID 103897497
(4-methoxy-6-methyl-2-pyridinyl)methylhydrazine
CID 82893343
N-cyclopentyloxy-1-(4-methoxy-6-methyl-2-pyridinyl)methanamine
CID 83235465
N-[[2-(aminomethyl)-4-pyridinyl]methyl]-3-methyloxan-3-amine
CID 114113993
3-[4-[[(3-methyloxan-3-yl)amino]methyl]triazol-1-yl]propan-1-ol
CID 114113524

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-methyloxan-3-amine?
The IUPAC name of N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-methyloxan-3-amine (CID 113354519) is N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-methyloxan-3-amine.
What is the SMILES notation for N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-methyloxan-3-amine?
The canonical SMILES for N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-methyloxan-3-amine is COc1cc(C)nc(CNC2(C)CCCOC2)c1.
What is the InChIKey of N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-methyloxan-3-amine?
The InChIKey is LRNRZEKQULUOFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-11-7-13(17-3)8-12(16-11)9-15-14(2)5-4-6-18-10-14/h7-8,15H,4-6,9-10H2,1-3H3.
What are the key properties of N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-methyloxan-3-amine?
N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-methyloxan-3-amine has a molecular weight of 250.34 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-3-methyloxan-3-amine is sourced from PubChem (CID 113354519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).