N-(1-cyclopropyl-2-methylpropyl)-2-hydroxyacetamide

C9H17NO2 — CID 143807183

IUPACN-(1-cyclopropyl-2-methylpropyl)-2-hydroxyacetamide
SMILESCC(C)C(NC(=O)CO)C1CC1
InChIInChI=1S/C9H17NO2/c1-6(2)9(7-3-4-7)10-8(12)5-11/h6-7,9,11H,3-5H2,1-2H3,(H,10,12)
InChIKeyLHBUSMQWZHZUKJ-UHFFFAOYSA-N
MW171.24 g/mol
LogP0.53
Rot. Bonds4

About N-(1-cyclopropyl-2-methylpropyl)-2-hydroxyacetamide

N-(1-cyclopropyl-2-methylpropyl)-2-hydroxyacetamide (PubChem CID 143807183) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is N-(1-cyclopropyl-2-methylpropyl)-2-hydroxyacetamide.

Molecular Properties

Compound NameN-(1-cyclopropyl-2-methylpropyl)-2-hydroxyacetamide
PubChem CID143807183
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC NameN-(1-cyclopropyl-2-methylpropyl)-2-hydroxyacetamide
SMILESCC(C)C(NC(=O)CO)C1CC1
InChIInChI=1S/C9H17NO2/c1-6(2)9(7-3-4-7)10-8(12)5-11/h6-7,9,11H,3-5H2,1-2H3,(H,10,12)
InChIKeyLHBUSMQWZHZUKJ-UHFFFAOYSA-N
XLogP0.53
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropyl-2-methylpropyl)-2-hydroxyacetamide?
The IUPAC name of N-(1-cyclopropyl-2-methylpropyl)-2-hydroxyacetamide (CID 143807183) is N-(1-cyclopropyl-2-methylpropyl)-2-hydroxyacetamide.
What is the SMILES notation for N-(1-cyclopropyl-2-methylpropyl)-2-hydroxyacetamide?
The canonical SMILES for N-(1-cyclopropyl-2-methylpropyl)-2-hydroxyacetamide is CC(C)C(NC(=O)CO)C1CC1.
What is the InChIKey of N-(1-cyclopropyl-2-methylpropyl)-2-hydroxyacetamide?
The InChIKey is LHBUSMQWZHZUKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2/c1-6(2)9(7-3-4-7)10-8(12)5-11/h6-7,9,11H,3-5H2,1-2H3,(H,10,12).
What are the key properties of N-(1-cyclopropyl-2-methylpropyl)-2-hydroxyacetamide?
N-(1-cyclopropyl-2-methylpropyl)-2-hydroxyacetamide has a molecular weight of 171.24 g/mol, XLogP of 0.53, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropyl-2-methylpropyl)-2-hydroxyacetamide is sourced from PubChem (CID 143807183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).