N-(1-hydroxy-2-methylpropan-2-yl)cyclopenta-1,3-diene-1-carboxamide

C10H15NO2 — CID 141292944

IUPACN-(1-hydroxy-2-methylpropan-2-yl)cyclopenta-1,3-diene-1-carboxamide
SMILESCC(C)(CO)NC(=O)C1=CC=CC1
InChIInChI=1S/C10H15NO2/c1-10(2,7-12)11-9(13)8-5-3-4-6-8/h3-5,12H,6-7H2,1-2H3,(H,11,13)
InChIKeyILDSZHWFGJDPGJ-UHFFFAOYSA-N
MW181.23 g/mol
LogP0.76
Rot. Bonds3

About N-(1-hydroxy-2-methylpropan-2-yl)cyclopenta-1,3-diene-1-carboxamide

N-(1-hydroxy-2-methylpropan-2-yl)cyclopenta-1,3-diene-1-carboxamide (PubChem CID 141292944) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is N-(1-hydroxy-2-methylpropan-2-yl)cyclopenta-1,3-diene-1-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-methylpropan-2-yl)cyclopenta-1,3-diene-1-carboxamide
PubChem CID141292944
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC NameN-(1-hydroxy-2-methylpropan-2-yl)cyclopenta-1,3-diene-1-carboxamide
SMILESCC(C)(CO)NC(=O)C1=CC=CC1
InChIInChI=1S/C10H15NO2/c1-10(2,7-12)11-9(13)8-5-3-4-6-8/h3-5,12H,6-7H2,1-2H3,(H,11,13)
InChIKeyILDSZHWFGJDPGJ-UHFFFAOYSA-N
XLogP0.76
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-dihydroxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
CID 103944768
6-fluoro-N-(1-hydroxy-2-methylpropan-2-yl)-2H-chromene-3-carboxamide
CID 110000594
2-bromo-5-fluoro-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
CID 14002103
N-(1-hydroxy-2-methylpropan-2-yl)-2,5-dimethylfuran-3-carboxamide
CID 43390484
N-(1-hydroxy-2-methylpropan-2-yl)-1,2,3,4-tetrahydroisoquinoline-6-carboxamide
CID 110489043
2,4,6-trifluoro-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
CID 65100569
3,5-difluoro-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
CID 43390562
2,4-dichloro-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
CID 821745
2-(dimethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
CID 110463483
N-(1-hydroxy-2-methylpropan-2-yl)naphthalene-2-carboxamide
CID 639967
2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide
CID 155213563
5-amino-2-chloro-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
CID 43498518

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)cyclopenta-1,3-diene-1-carboxamide?
The IUPAC name of N-(1-hydroxy-2-methylpropan-2-yl)cyclopenta-1,3-diene-1-carboxamide (CID 141292944) is N-(1-hydroxy-2-methylpropan-2-yl)cyclopenta-1,3-diene-1-carboxamide.
What is the SMILES notation for N-(1-hydroxy-2-methylpropan-2-yl)cyclopenta-1,3-diene-1-carboxamide?
The canonical SMILES for N-(1-hydroxy-2-methylpropan-2-yl)cyclopenta-1,3-diene-1-carboxamide is CC(C)(CO)NC(=O)C1=CC=CC1.
What is the InChIKey of N-(1-hydroxy-2-methylpropan-2-yl)cyclopenta-1,3-diene-1-carboxamide?
The InChIKey is ILDSZHWFGJDPGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-10(2,7-12)11-9(13)8-5-3-4-6-8/h3-5,12H,6-7H2,1-2H3,(H,11,13).
What are the key properties of N-(1-hydroxy-2-methylpropan-2-yl)cyclopenta-1,3-diene-1-carboxamide?
N-(1-hydroxy-2-methylpropan-2-yl)cyclopenta-1,3-diene-1-carboxamide has a molecular weight of 181.23 g/mol, XLogP of 0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-methylpropan-2-yl)cyclopenta-1,3-diene-1-carboxamide is sourced from PubChem (CID 141292944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).