azane;1,3-dimethoxybenzene

C8H13NO2 — CID 70210283

IUPACazane;1,3-dimethoxybenzene
SMILESCOc1cccc(OC)c1.N
InChIInChI=1S/C8H10O2.H3N/c1-9-7-4-3-5-8(6-7)10-2;/h3-6H,1-2H3;1H3
InChIKeyPKMUKOVUAGGNTQ-UHFFFAOYSA-N
MW155.20 g/mol
LogP1.87
Rot. Bonds2

About azane;1,3-dimethoxybenzene

azane;1,3-dimethoxybenzene (PubChem CID 70210283) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is azane;1,3-dimethoxybenzene.

Molecular Properties

Compound Nameazane;1,3-dimethoxybenzene
PubChem CID70210283
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Nameazane;1,3-dimethoxybenzene
SMILESCOc1cccc(OC)c1.N
InChIInChI=1S/C8H10O2.H3N/c1-9-7-4-3-5-8(6-7)10-2;/h3-6H,1-2H3;1H3
InChIKeyPKMUKOVUAGGNTQ-UHFFFAOYSA-N
XLogP1.87
TPSA53.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

tris(1,3-dimethoxybenzene);phosphane
CID 160853878
CID 172849383
CID 172849383
carbanide;1,3-dimethoxybenzene;rubidium(1+)
CID 160752391
calcium;1,3-dimethoxybenzene;hydride
CID 174808068
1,3-dimethoxybenzene;1,4-dimethoxybenzene
CID 91359455
azane;1-methoxy-3-(3-methoxyphenyl)benzene
CID 174719266
1-methoxy-3-[4-[4-(3-methoxyphenoxy)phenoxy]phenoxy]benzene
CID 139804491
CID 139245906
CID 139245906
1-methoxy-3-(3-methoxyphenyl)benzene;sulfane
CID 175169762
1,3-bis(4-methoxyphenoxy)benzene
CID 629519
CID 153354664
CID 153354664
CID 10458332
CID 10458332

Frequently Asked Questions

What is the IUPAC name of azane;1,3-dimethoxybenzene?
The IUPAC name of azane;1,3-dimethoxybenzene (CID 70210283) is azane;1,3-dimethoxybenzene.
What is the SMILES notation for azane;1,3-dimethoxybenzene?
The canonical SMILES for azane;1,3-dimethoxybenzene is COc1cccc(OC)c1.N.
What is the InChIKey of azane;1,3-dimethoxybenzene?
The InChIKey is PKMUKOVUAGGNTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O2.H3N/c1-9-7-4-3-5-8(6-7)10-2;/h3-6H,1-2H3;1H3.
What are the key properties of azane;1,3-dimethoxybenzene?
azane;1,3-dimethoxybenzene has a molecular weight of 155.20 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azane;1,3-dimethoxybenzene is sourced from PubChem (CID 70210283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).