5-amino-N-(1-hydroxy-2-methylpropan-2-yl)furan-2-carboxamide

C9H14N2O3 — CID 82344173

IUPAC5-amino-N-(1-hydroxy-2-methylpropan-2-yl)furan-2-carboxamide
SMILESCC(C)(CO)NC(=O)c1ccc(N)o1
InChIInChI=1S/C9H14N2O3/c1-9(2,5-12)11-8(13)6-3-4-7(10)14-6/h3-4,12H,5,10H2,1-2H3,(H,11,13)
InChIKeyCBLDDPSCCNDAID-UHFFFAOYSA-N
MW198.22 g/mol
LogP0.36
Rot. Bonds3

About 5-amino-N-(1-hydroxy-2-methylpropan-2-yl)furan-2-carboxamide

5-amino-N-(1-hydroxy-2-methylpropan-2-yl)furan-2-carboxamide (PubChem CID 82344173) has the molecular formula C9H14N2O3 and a molecular weight of 198.22 g/mol. Its IUPAC name is 5-amino-N-(1-hydroxy-2-methylpropan-2-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-(1-hydroxy-2-methylpropan-2-yl)furan-2-carboxamide
PubChem CID82344173
Molecular FormulaC9H14N2O3
Molecular Weight198.22 g/mol
Exact Mass198.10
IUPAC Name5-amino-N-(1-hydroxy-2-methylpropan-2-yl)furan-2-carboxamide
SMILESCC(C)(CO)NC(=O)c1ccc(N)o1
InChIInChI=1S/C9H14N2O3/c1-9(2,5-12)11-8(13)6-3-4-7(10)14-6/h3-4,12H,5,10H2,1-2H3,(H,11,13)
InChIKeyCBLDDPSCCNDAID-UHFFFAOYSA-N
XLogP0.36
TPSA88.49 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 50.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

Ethyl 3-hydroxy-2-[(5-nitrofuran-2-carbonyl)amino]propanoate
CID 44522892
N-(2-cyanopropan-2-yl)furan-2-carboxamide
CID 565206
N-tert-butyl-5-nitrofuran-2-carboxamide
CID 47105769
N-(1-hydroxy-2-methylpropan-2-yl)-5-nitrofuran-2-carboxamide
CID 14783751
N-[3-(2,2-dimethylaziridin-1-yl)-2-hydroxypropyl]-5-nitrofuran-2-carboxamide
CID 14783754
Ethyl 5-{[ethoxy(oxo)acetyl]amino}furan-2-carboxylate
CID 271569
N-(3-methoxypropyl)-5-nitrofuran-2-carboxamide
CID 1722517
N-tert-butylfuran-2-carboxamide
CID 963338
Furyl furamide
CID 10702442
N-[5-(Azepane-1-carbonyl)furan-2-YL]acetamide
CID 53016004
5-[2,5-dihydroxy-3-(trifluoromethyl)-2,5-dihydropyrrol-1-yl]-N-methylfuran-2-carboxamide
CID 141514052
5-amino-N-[(2E,4Z)-1-fluorohepta-2,4-dien-6-yn-2-yl]furan-2-carboxamide
CID 166994438

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(1-hydroxy-2-methylpropan-2-yl)furan-2-carboxamide?
The IUPAC name of 5-amino-N-(1-hydroxy-2-methylpropan-2-yl)furan-2-carboxamide (CID 82344173) is 5-amino-N-(1-hydroxy-2-methylpropan-2-yl)furan-2-carboxamide.
What is the SMILES notation for 5-amino-N-(1-hydroxy-2-methylpropan-2-yl)furan-2-carboxamide?
The canonical SMILES for 5-amino-N-(1-hydroxy-2-methylpropan-2-yl)furan-2-carboxamide is CC(C)(CO)NC(=O)c1ccc(N)o1.
What is the InChIKey of 5-amino-N-(1-hydroxy-2-methylpropan-2-yl)furan-2-carboxamide?
The InChIKey is CBLDDPSCCNDAID-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O3/c1-9(2,5-12)11-8(13)6-3-4-7(10)14-6/h3-4,12H,5,10H2,1-2H3,(H,11,13).
What are the key properties of 5-amino-N-(1-hydroxy-2-methylpropan-2-yl)furan-2-carboxamide?
5-amino-N-(1-hydroxy-2-methylpropan-2-yl)furan-2-carboxamide has a molecular weight of 198.22 g/mol, XLogP of 0.36, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(1-hydroxy-2-methylpropan-2-yl)furan-2-carboxamide is sourced from PubChem (CID 82344173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).