N-tert-butyl-N-cyclopentyl-3-hydroxypropanamide

C12H23NO2 — CID 164773631

IUPACN-tert-butyl-N-cyclopentyl-3-hydroxypropanamide
SMILESCC(C)(C)N(C(=O)CCO)C1CCCC1
InChIInChI=1S/C12H23NO2/c1-12(2,3)13(11(15)8-9-14)10-6-4-5-7-10/h10,14H,4-9H2,1-3H3
InChIKeyLPLOJUIQPGQOLG-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.94
Rot. Bonds3

About N-tert-butyl-N-cyclopentyl-3-hydroxypropanamide

N-tert-butyl-N-cyclopentyl-3-hydroxypropanamide (PubChem CID 164773631) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is N-tert-butyl-N-cyclopentyl-3-hydroxypropanamide.

Molecular Properties

Compound NameN-tert-butyl-N-cyclopentyl-3-hydroxypropanamide
PubChem CID164773631
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC NameN-tert-butyl-N-cyclopentyl-3-hydroxypropanamide
SMILESCC(C)(C)N(C(=O)CCO)C1CCCC1
InChIInChI=1S/C12H23NO2/c1-12(2,3)13(11(15)8-9-14)10-6-4-5-7-10/h10,14H,4-9H2,1-3H3
InChIKeyLPLOJUIQPGQOLG-UHFFFAOYSA-N
XLogP1.94
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

benzene;N-cyclohexyl-N-(cyclopropylmethyl)-3-hydroxypropanamide;ethane
CID 142880292
N-cycloheptyl-2-hydroxy-N-methylacetamide
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N-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide
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N-tert-butyl-N-cyclohexyl-2-diazoacetamide
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N-cyclobutyl-2-hydroxy-N-methylacetamide
CID 115139792
N-cyclopentyl-N-(2-hydroxyethyl)-3-sulfanylpropanamide
CID 107026376
2-[tert-butyl(cyclopentyl)amino]acetic acid
CID 79268396
tert-butyl-[4-(dicyclopropylamino)cyclohexyl]carbamic acid
CID 67126555
tert-butyl-(1-cyclobutylpiperidin-4-yl)carbamic acid
CID 66868621
N-(2-cyclopentyl-2-methylpropyl)-3-hydroxypropanamide
CID 115139545
N-cyclobutyl-2-(dimethylamino)-N-(2-hydroxyethyl)acetamide
CID 102685214
N-tert-butyl-N-cyclopropyl-2-methylpropanamide
CID 153456658

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-N-cyclopentyl-3-hydroxypropanamide?
The IUPAC name of N-tert-butyl-N-cyclopentyl-3-hydroxypropanamide (CID 164773631) is N-tert-butyl-N-cyclopentyl-3-hydroxypropanamide.
What is the SMILES notation for N-tert-butyl-N-cyclopentyl-3-hydroxypropanamide?
The canonical SMILES for N-tert-butyl-N-cyclopentyl-3-hydroxypropanamide is CC(C)(C)N(C(=O)CCO)C1CCCC1.
What is the InChIKey of N-tert-butyl-N-cyclopentyl-3-hydroxypropanamide?
The InChIKey is LPLOJUIQPGQOLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-12(2,3)13(11(15)8-9-14)10-6-4-5-7-10/h10,14H,4-9H2,1-3H3.
What are the key properties of N-tert-butyl-N-cyclopentyl-3-hydroxypropanamide?
N-tert-butyl-N-cyclopentyl-3-hydroxypropanamide has a molecular weight of 213.32 g/mol, XLogP of 1.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-N-cyclopentyl-3-hydroxypropanamide is sourced from PubChem (CID 164773631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).