lithium;hydride;2-methylbenzoic acid;N-methylmethanamine

C10H16LiNO2 — CID 173248738

IUPAClithium;hydride;2-methylbenzoic acid;N-methylmethanamine
SMILESCNC.Cc1ccccc1C(=O)O.[H-].[Li+]
InChIInChI=1S/C8H8O2.C2H7N.Li.H/c1-6-4-2-3-5-7(6)8(9)10;1-3-2;;/h2-5H,1H3,(H,9,10);3H,1-2H3;;/q;;+1;-1
InChIKeyGXKFNEWGKWBBLS-UHFFFAOYSA-N
MW189.18 g/mol
LogP-1.35
Rot. Bonds1

About lithium;hydride;2-methylbenzoic acid;N-methylmethanamine

lithium;hydride;2-methylbenzoic acid;N-methylmethanamine (PubChem CID 173248738) has the molecular formula C10H16LiNO2 and a molecular weight of 189.18 g/mol. Its IUPAC name is lithium;hydride;2-methylbenzoic acid;N-methylmethanamine.

Molecular Properties

Compound Namelithium;hydride;2-methylbenzoic acid;N-methylmethanamine
PubChem CID173248738
Molecular FormulaC10H16LiNO2
Molecular Weight189.18 g/mol
Exact Mass189.13
IUPAC Namelithium;hydride;2-methylbenzoic acid;N-methylmethanamine
SMILESCNC.Cc1ccccc1C(=O)O.[H-].[Li+]
InChIInChI=1S/C8H8O2.C2H7N.Li.H/c1-6-4-2-3-5-7(6)8(9)10;1-3-2;;/h2-5H,1H3,(H,9,10);3H,1-2H3;;/q;;+1;-1
InChIKeyGXKFNEWGKWBBLS-UHFFFAOYSA-N
XLogP-1.35
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.18
LogP ≤ 5-1.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of lithium;hydride;2-methylbenzoic acid;N-methylmethanamine?
The IUPAC name of lithium;hydride;2-methylbenzoic acid;N-methylmethanamine (CID 173248738) is lithium;hydride;2-methylbenzoic acid;N-methylmethanamine.
What is the SMILES notation for lithium;hydride;2-methylbenzoic acid;N-methylmethanamine?
The canonical SMILES for lithium;hydride;2-methylbenzoic acid;N-methylmethanamine is CNC.Cc1ccccc1C(=O)O.[H-].[Li+].
What is the InChIKey of lithium;hydride;2-methylbenzoic acid;N-methylmethanamine?
The InChIKey is GXKFNEWGKWBBLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8O2.C2H7N.Li.H/c1-6-4-2-3-5-7(6)8(9)10;1-3-2;;/h2-5H,1H3,(H,9,10);3H,1-2H3;;/q;;+1;-1.
What are the key properties of lithium;hydride;2-methylbenzoic acid;N-methylmethanamine?
lithium;hydride;2-methylbenzoic acid;N-methylmethanamine has a molecular weight of 189.18 g/mol, XLogP of -1.35, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;hydride;2-methylbenzoic acid;N-methylmethanamine is sourced from PubChem (CID 173248738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).