2-methyl-N-naphthalen-1-ylfuran-3-carboxamide

C16H13NO2 — CID 877334

IUPAC2-methyl-N-naphthalen-1-ylfuran-3-carboxamide
SMILESCc1occc1C(=O)Nc1cccc2ccccc12
InChIInChI=1S/C16H13NO2/c1-11-13(9-10-19-11)16(18)17-15-8-4-6-12-5-2-3-7-14(12)15/h2-10H,1H3,(H,17,18)
InChIKeyWBDRUIASTAIQBB-UHFFFAOYSA-N
MW251.28 g/mol
LogP3.99
Rot. Bonds2

About 2-methyl-N-naphthalen-1-ylfuran-3-carboxamide

2-methyl-N-naphthalen-1-ylfuran-3-carboxamide (PubChem CID 877334) has the molecular formula C16H13NO2 and a molecular weight of 251.28 g/mol. Its IUPAC name is 2-methyl-N-naphthalen-1-ylfuran-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-naphthalen-1-ylfuran-3-carboxamide
PubChem CID877334
Molecular FormulaC16H13NO2
Molecular Weight251.28 g/mol
Exact Mass251.09
IUPAC Name2-methyl-N-naphthalen-1-ylfuran-3-carboxamide
SMILESCc1occc1C(=O)Nc1cccc2ccccc12
InChIInChI=1S/C16H13NO2/c1-11-13(9-10-19-11)16(18)17-15-8-4-6-12-5-2-3-7-14(12)15/h2-10H,1H3,(H,17,18)
InChIKeyWBDRUIASTAIQBB-UHFFFAOYSA-N
XLogP3.99
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.28
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Methfuroxam
CID 34313
Fenfuram
CID 90590
2,5-Dimethyl-3-furancarboxanilide
CID 34281
Mls003171585
CID 347463
3-Methyl-furan-2-carboxylic acid naphthalen-1-ylamide
CID 573330
2,5-dimethyl-N-naphthalen-2-ylfuran-3-carboxamide
CID 757751
5-Acetyl-2-methyl-furan-3-carboxylic acid naphthalen-2-ylamide
CID 790801
4-Furan-2-yl-3,4-dihydro-1H-benzo[h]quinolin-2-one
CID 649197
2,5-dimethyl-N-naphthalen-1-ylfuran-3-carboxamide
CID 705541
2-methyl-N-(4-phenylmethoxyphenyl)furan-3-carboxamide
CID 800833
N-methyl-N-(2-naphthyl)-3-furamide
CID 849880
5-Methyl-furan-3-carboxylic acid (4-methoxy-phenyl)-amide
CID 1075689

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-naphthalen-1-ylfuran-3-carboxamide?
The IUPAC name of 2-methyl-N-naphthalen-1-ylfuran-3-carboxamide (CID 877334) is 2-methyl-N-naphthalen-1-ylfuran-3-carboxamide.
What is the SMILES notation for 2-methyl-N-naphthalen-1-ylfuran-3-carboxamide?
The canonical SMILES for 2-methyl-N-naphthalen-1-ylfuran-3-carboxamide is Cc1occc1C(=O)Nc1cccc2ccccc12.
What is the InChIKey of 2-methyl-N-naphthalen-1-ylfuran-3-carboxamide?
The InChIKey is WBDRUIASTAIQBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO2/c1-11-13(9-10-19-11)16(18)17-15-8-4-6-12-5-2-3-7-14(12)15/h2-10H,1H3,(H,17,18).
What are the key properties of 2-methyl-N-naphthalen-1-ylfuran-3-carboxamide?
2-methyl-N-naphthalen-1-ylfuran-3-carboxamide has a molecular weight of 251.28 g/mol, XLogP of 3.99, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-naphthalen-1-ylfuran-3-carboxamide is sourced from PubChem (CID 877334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).