N-(cyclobutylmethyl)-2-hydroxy-2-methylpropanamide

C9H17NO2 — CID 103429487

IUPACN-(cyclobutylmethyl)-2-hydroxy-2-methylpropanamide
SMILESCC(C)(O)C(=O)NCC1CCC1
InChIInChI=1S/C9H17NO2/c1-9(2,12)8(11)10-6-7-4-3-5-7/h7,12H,3-6H2,1-2H3,(H,10,11)
InChIKeyJWNAVRXRLRIKFX-UHFFFAOYSA-N
MW171.24 g/mol
LogP0.67
Rot. Bonds3

About N-(cyclobutylmethyl)-2-hydroxy-2-methylpropanamide

N-(cyclobutylmethyl)-2-hydroxy-2-methylpropanamide (PubChem CID 103429487) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-2-hydroxy-2-methylpropanamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-2-hydroxy-2-methylpropanamide
PubChem CID103429487
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC NameN-(cyclobutylmethyl)-2-hydroxy-2-methylpropanamide
SMILESCC(C)(O)C(=O)NCC1CCC1
InChIInChI=1S/C9H17NO2/c1-9(2,12)8(11)10-6-7-4-3-5-7/h7,12H,3-6H2,1-2H3,(H,10,11)
InChIKeyJWNAVRXRLRIKFX-UHFFFAOYSA-N
XLogP0.67
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-2-hydroxy-2-methylpropanamide?
The IUPAC name of N-(cyclobutylmethyl)-2-hydroxy-2-methylpropanamide (CID 103429487) is N-(cyclobutylmethyl)-2-hydroxy-2-methylpropanamide.
What is the SMILES notation for N-(cyclobutylmethyl)-2-hydroxy-2-methylpropanamide?
The canonical SMILES for N-(cyclobutylmethyl)-2-hydroxy-2-methylpropanamide is CC(C)(O)C(=O)NCC1CCC1.
What is the InChIKey of N-(cyclobutylmethyl)-2-hydroxy-2-methylpropanamide?
The InChIKey is JWNAVRXRLRIKFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2/c1-9(2,12)8(11)10-6-7-4-3-5-7/h7,12H,3-6H2,1-2H3,(H,10,11).
What are the key properties of N-(cyclobutylmethyl)-2-hydroxy-2-methylpropanamide?
N-(cyclobutylmethyl)-2-hydroxy-2-methylpropanamide has a molecular weight of 171.24 g/mol, XLogP of 0.67, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-2-hydroxy-2-methylpropanamide is sourced from PubChem (CID 103429487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).