ethane;6-methyl-3,5-dihydro-2H-furo[2,3-c]pyrrole;molecular hydrogen

C9H17NO — CID 144904695

IUPACethane;6-methyl-3,5-dihydro-2H-furo[2,3-c]pyrrole;molecular hydrogen
SMILESCC.Cc1[nH]cc2c1OCC2.[H][H]
InChIInChI=1S/C7H9NO.C2H6.H2/c1-5-7-6(4-8-5)2-3-9-7;1-2;/h4,8H,2-3H2,1H3;1-2H3;1H
InChIKeyCQKUTZRDQFNBAQ-UHFFFAOYSA-N
MW155.24 g/mol
LogP2.53
Rot. Bonds

About ethane;6-methyl-3,5-dihydro-2H-furo[2,3-c]pyrrole;molecular hydrogen

ethane;6-methyl-3,5-dihydro-2H-furo[2,3-c]pyrrole;molecular hydrogen (PubChem CID 144904695) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is ethane;6-methyl-3,5-dihydro-2H-furo[2,3-c]pyrrole;molecular hydrogen.

Molecular Properties

Compound Nameethane;6-methyl-3,5-dihydro-2H-furo[2,3-c]pyrrole;molecular hydrogen
PubChem CID144904695
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Nameethane;6-methyl-3,5-dihydro-2H-furo[2,3-c]pyrrole;molecular hydrogen
SMILESCC.Cc1[nH]cc2c1OCC2.[H][H]
InChIInChI=1S/C7H9NO.C2H6.H2/c1-5-7-6(4-8-5)2-3-9-7;1-2;/h4,8H,2-3H2,1H3;1-2H3;1H
InChIKeyCQKUTZRDQFNBAQ-UHFFFAOYSA-N
XLogP2.53
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;7-methyl-2,3-dihydro-1-benzofuran
CID 91503061
ethane;7-methyl-2,3-dihydrofuro[3,2-c]pyridine
CID 163273368
ethane;7-fluoro-5-methyl-2,3-dihydro-1-benzofuran
CID 177214189
4,6-dimethyl-3,5-dihydro-2H-furo[2,3-c]pyrrole
CID 130401378
methyl-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)phosphane
CID 143317684
5-methyl-7-(4-methylphenyl)-2,3-dihydro-1-benzofuran;propane
CID 142100880
ethane;3-methyl-5,6-dihydrofuro[2,3-c]pyridazine
CID 145497461
5-methyl-7-(5-methylthiophen-2-yl)-2,3-dihydro-1-benzofuran
CID 23543547
[5-(3,5-dimethylphenyl)-2,3-dihydro-1-benzofuran-7-yl]methanamine
CID 104703299
2-(7-methyl-2,3-dihydro-1-benzofuran-5-yl)propan-2-amine
CID 117282534
7-(4-methylphenyl)-2,3-dihydro-1-benzofuran
CID 23543625
6-methoxy-2,3-dihydro-1-benzofuran-7-thiol
CID 168942495

Frequently Asked Questions

What is the IUPAC name of ethane;6-methyl-3,5-dihydro-2H-furo[2,3-c]pyrrole;molecular hydrogen?
The IUPAC name of ethane;6-methyl-3,5-dihydro-2H-furo[2,3-c]pyrrole;molecular hydrogen (CID 144904695) is ethane;6-methyl-3,5-dihydro-2H-furo[2,3-c]pyrrole;molecular hydrogen.
What is the SMILES notation for ethane;6-methyl-3,5-dihydro-2H-furo[2,3-c]pyrrole;molecular hydrogen?
The canonical SMILES for ethane;6-methyl-3,5-dihydro-2H-furo[2,3-c]pyrrole;molecular hydrogen is CC.Cc1[nH]cc2c1OCC2.[H][H].
What is the InChIKey of ethane;6-methyl-3,5-dihydro-2H-furo[2,3-c]pyrrole;molecular hydrogen?
The InChIKey is CQKUTZRDQFNBAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO.C2H6.H2/c1-5-7-6(4-8-5)2-3-9-7;1-2;/h4,8H,2-3H2,1H3;1-2H3;1H.
What are the key properties of ethane;6-methyl-3,5-dihydro-2H-furo[2,3-c]pyrrole;molecular hydrogen?
ethane;6-methyl-3,5-dihydro-2H-furo[2,3-c]pyrrole;molecular hydrogen has a molecular weight of 155.24 g/mol, XLogP of 2.53, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-methyl-3,5-dihydro-2H-furo[2,3-c]pyrrole;molecular hydrogen is sourced from PubChem (CID 144904695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).