N-(2-hydroxyethyl)-2,2-dimethyl-3-(1-methylcyclopropyl)propanamide

C11H21NO2 — CID 123648661

IUPACN-(2-hydroxyethyl)-2,2-dimethyl-3-(1-methylcyclopropyl)propanamide
SMILESCC1(CC(C)(C)C(=O)NCCO)CC1
InChIInChI=1S/C11H21NO2/c1-10(2,8-11(3)4-5-11)9(14)12-6-7-13/h13H,4-8H2,1-3H3,(H,12,14)
InChIKeyPLSJNZVJISTXHG-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.31
Rot. Bonds5

About N-(2-hydroxyethyl)-2,2-dimethyl-3-(1-methylcyclopropyl)propanamide

N-(2-hydroxyethyl)-2,2-dimethyl-3-(1-methylcyclopropyl)propanamide (PubChem CID 123648661) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2,2-dimethyl-3-(1-methylcyclopropyl)propanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2,2-dimethyl-3-(1-methylcyclopropyl)propanamide
PubChem CID123648661
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN-(2-hydroxyethyl)-2,2-dimethyl-3-(1-methylcyclopropyl)propanamide
SMILESCC1(CC(C)(C)C(=O)NCCO)CC1
InChIInChI=1S/C11H21NO2/c1-10(2,8-11(3)4-5-11)9(14)12-6-7-13/h13H,4-8H2,1-3H3,(H,12,14)
InChIKeyPLSJNZVJISTXHG-UHFFFAOYSA-N
XLogP1.31
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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N-(2-hydroxyethyl)-3,5,5-trimethylhexanamide
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CID 89973003
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CID 105646400

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2,2-dimethyl-3-(1-methylcyclopropyl)propanamide?
The IUPAC name of N-(2-hydroxyethyl)-2,2-dimethyl-3-(1-methylcyclopropyl)propanamide (CID 123648661) is N-(2-hydroxyethyl)-2,2-dimethyl-3-(1-methylcyclopropyl)propanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2,2-dimethyl-3-(1-methylcyclopropyl)propanamide?
The canonical SMILES for N-(2-hydroxyethyl)-2,2-dimethyl-3-(1-methylcyclopropyl)propanamide is CC1(CC(C)(C)C(=O)NCCO)CC1.
What is the InChIKey of N-(2-hydroxyethyl)-2,2-dimethyl-3-(1-methylcyclopropyl)propanamide?
The InChIKey is PLSJNZVJISTXHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-10(2,8-11(3)4-5-11)9(14)12-6-7-13/h13H,4-8H2,1-3H3,(H,12,14).
What are the key properties of N-(2-hydroxyethyl)-2,2-dimethyl-3-(1-methylcyclopropyl)propanamide?
N-(2-hydroxyethyl)-2,2-dimethyl-3-(1-methylcyclopropyl)propanamide has a molecular weight of 199.29 g/mol, XLogP of 1.31, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2,2-dimethyl-3-(1-methylcyclopropyl)propanamide is sourced from PubChem (CID 123648661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).