methylcarbamic acid;naphthalen-2-ol

C12H13NO3 — CID 57349809

IUPACmethylcarbamic acid;naphthalen-2-ol
SMILESCNC(=O)O.Oc1ccc2ccccc2c1
InChIInChI=1S/C10H8O.C2H5NO2/c11-10-6-5-8-3-1-2-4-9(8)7-10;1-3-2(4)5/h1-7,11H;3H,1H3,(H,4,5)
InChIKeyZBIBGGVHHNRSGI-UHFFFAOYSA-N
MW219.24 g/mol
LogP2.43
Rot. Bonds

About methylcarbamic acid;naphthalen-2-ol

methylcarbamic acid;naphthalen-2-ol (PubChem CID 57349809) has the molecular formula C12H13NO3 and a molecular weight of 219.24 g/mol. Its IUPAC name is methylcarbamic acid;naphthalen-2-ol.

Molecular Properties

Compound Namemethylcarbamic acid;naphthalen-2-ol
PubChem CID57349809
Molecular FormulaC12H13NO3
Molecular Weight219.24 g/mol
Exact Mass219.09
IUPAC Namemethylcarbamic acid;naphthalen-2-ol
SMILESCNC(=O)O.Oc1ccc2ccccc2c1
InChIInChI=1S/C10H8O.C2H5NO2/c11-10-6-5-8-3-1-2-4-9(8)7-10;1-3-2(4)5/h1-7,11H;3H,1H3,(H,4,5)
InChIKeyZBIBGGVHHNRSGI-UHFFFAOYSA-N
XLogP2.43
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 52.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;naphthalen-2-ol
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naphthalen-2-ol
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benzene;benzenesulfonic acid;naphthalen-2-ol
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CID 53442833
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naphthalen-2-ol;nitrobenzene
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naphthalen-2-ol;phenylmethoxymethylbenzene
CID 18786875
3-hydroxy-5-(6-hydroxynaphthalen-2-yl)-N-methylbenzamide
CID 24950040
1-methyl-3-naphthalen-2-ylurea
CID 3454681
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Frequently Asked Questions

What is the IUPAC name of methylcarbamic acid;naphthalen-2-ol?
The IUPAC name of methylcarbamic acid;naphthalen-2-ol (CID 57349809) is methylcarbamic acid;naphthalen-2-ol.
What is the SMILES notation for methylcarbamic acid;naphthalen-2-ol?
The canonical SMILES for methylcarbamic acid;naphthalen-2-ol is CNC(=O)O.Oc1ccc2ccccc2c1.
What is the InChIKey of methylcarbamic acid;naphthalen-2-ol?
The InChIKey is ZBIBGGVHHNRSGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8O.C2H5NO2/c11-10-6-5-8-3-1-2-4-9(8)7-10;1-3-2(4)5/h1-7,11H;3H,1H3,(H,4,5).
What are the key properties of methylcarbamic acid;naphthalen-2-ol?
methylcarbamic acid;naphthalen-2-ol has a molecular weight of 219.24 g/mol, XLogP of 2.43, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methylcarbamic acid;naphthalen-2-ol is sourced from PubChem (CID 57349809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).