N-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide

C10H13NO2 — CID 115968439

IUPACN-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide
SMILESC=C(C)CN(C)C(=O)c1ccco1
InChIInChI=1S/C10H13NO2/c1-8(2)7-11(3)10(12)9-5-4-6-13-9/h4-6H,1,7H2,2-3H3
InChIKeyYLJPDNXUGLESPN-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.93
Rot. Bonds3

About N-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide

N-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide (PubChem CID 115968439) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is N-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide
PubChem CID115968439
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC NameN-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide
SMILESC=C(C)CN(C)C(=O)c1ccco1
InChIInChI=1S/C10H13NO2/c1-8(2)7-11(3)10(12)9-5-4-6-13-9/h4-6H,1,7H2,2-3H3
InChIKeyYLJPDNXUGLESPN-UHFFFAOYSA-N
XLogP1.93
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-[furan-2-carbonyl(methyl)amino]acetate
CID 6943452
methyl 2-[furan-2-carbonyl(methyl)amino]acetate
CID 43407344
N-(2-amino-2-hydroxyiminoethyl)-N-methylfuran-2-carboxamide
CID 76928863
N-(2-hydroxyethyl)-N-methylfuran-2-carboxamide
CID 15134402
N-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide
CID 55060862
tert-butyl 2-[furan-2-carbonyl(methyl)amino]acetate
CID 78991307
N-[2-[2-hydroxyethyl(prop-2-enyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide
CID 115775719
propyl 2-[furan-2-carbonyl(methyl)amino]acetate
CID 91700657
N-butyl-N-methylfuran-2-carboxamide
CID 60670878
3-[ethyl-[2-[furan-2-carbonyl(methyl)amino]acetyl]amino]propanoic acid
CID 61008405
3-[[2-[furan-2-carbonyl(methyl)amino]acetyl]amino]propanoic acid
CID 43170664
N-[2-(azepan-1-yl)-2-oxoethyl]-N-methylfuran-2-carboxamide
CID 60715665

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide?
The IUPAC name of N-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide (CID 115968439) is N-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide.
What is the SMILES notation for N-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide?
The canonical SMILES for N-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide is C=C(C)CN(C)C(=O)c1ccco1.
What is the InChIKey of N-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide?
The InChIKey is YLJPDNXUGLESPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2/c1-8(2)7-11(3)10(12)9-5-4-6-13-9/h4-6H,1,7H2,2-3H3.
What are the key properties of N-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide?
N-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide has a molecular weight of 179.22 g/mol, XLogP of 1.93, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylprop-2-enyl)furan-2-carboxamide is sourced from PubChem (CID 115968439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).