6-methoxy-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine

C12H18N2O3 — CID 104762670

IUPAC6-methoxy-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine
SMILESCOc1cccc(NCC2(OC)CCOC2)n1
InChIInChI=1S/C12H18N2O3/c1-15-11-5-3-4-10(14-11)13-8-12(16-2)6-7-17-9-12/h3-5H,6-9H2,1-2H3,(H,13,14)
InChIKeyXCHFYINOKKKFNR-UHFFFAOYSA-N
MW238.29 g/mol
LogP1.31
Rot. Bonds5

About 6-methoxy-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine

6-methoxy-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine (PubChem CID 104762670) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is 6-methoxy-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name6-methoxy-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine
PubChem CID104762670
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC Name6-methoxy-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine
SMILESCOc1cccc(NCC2(OC)CCOC2)n1
InChIInChI=1S/C12H18N2O3/c1-15-11-5-3-4-10(14-11)13-8-12(16-2)6-7-17-9-12/h3-5H,6-9H2,1-2H3,(H,13,14)
InChIKeyXCHFYINOKKKFNR-UHFFFAOYSA-N
XLogP1.31
TPSA52.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 4-[(3-methoxyoxolan-3-yl)methylamino]pyrimidine-2-carboxylate
CID 104762745
N-[(3-methoxyoxolan-3-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine
CID 113450436
6-ethoxy-N-[(1-methoxycyclobutyl)methyl]pyridin-2-amine
CID 114119681
4-N-[(3-methoxyoxolan-3-yl)methyl]-6-N-methylpyrimidine-4,6-diamine
CID 104767329
6-chloro-N-[(3-methoxyoxolan-3-yl)methyl]pyrazin-2-amine
CID 104705608
6-hydrazinyl-4-N-[(3-methoxyoxolan-3-yl)methyl]pyrimidine-2,4-diamine
CID 104767560
6-N-ethyl-4-N-[(3-methoxyoxolan-3-yl)methyl]-2-propylpyrimidine-4,6-diamine
CID 104767328
N-[[1-(aminomethyl)cyclopentyl]methyl]-6-methoxypyridin-2-amine
CID 115366027
2-cyclopropyl-N-[(4-methoxyoxan-4-yl)methyl]pyrimidin-4-amine
CID 133400059
2-cyclopropyl-6-N-ethyl-4-N-[(3-methoxyoxolan-3-yl)methyl]pyrimidine-4,6-diamine
CID 104767445
N-[(3-methoxyoxolan-3-yl)methyl]-2-(trifluoromethyl)aniline
CID 104762720
3-fluoro-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine
CID 104705532

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine?
The IUPAC name of 6-methoxy-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine (CID 104762670) is 6-methoxy-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 6-methoxy-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine?
The canonical SMILES for 6-methoxy-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine is COc1cccc(NCC2(OC)CCOC2)n1.
What is the InChIKey of 6-methoxy-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine?
The InChIKey is XCHFYINOKKKFNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-15-11-5-3-4-10(14-11)13-8-12(16-2)6-7-17-9-12/h3-5H,6-9H2,1-2H3,(H,13,14).
What are the key properties of 6-methoxy-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine?
6-methoxy-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine has a molecular weight of 238.29 g/mol, XLogP of 1.31, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-[(3-methoxyoxolan-3-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 104762670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).