N-(1-hydroxypyrrolidin-3-yl)-3,3-dimethylbutanamide

C10H20N2O2 — CID 135300785

IUPACN-(1-hydroxypyrrolidin-3-yl)-3,3-dimethylbutanamide
SMILESCC(C)(C)CC(=O)NC1CCN(O)C1
InChIInChI=1S/C10H20N2O2/c1-10(2,3)6-9(13)11-8-4-5-12(14)7-8/h8,14H,4-7H2,1-3H3,(H,11,13)
InChIKeyTXHUASIKEYLMBY-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.00
Rot. Bonds2

About N-(1-hydroxypyrrolidin-3-yl)-3,3-dimethylbutanamide

N-(1-hydroxypyrrolidin-3-yl)-3,3-dimethylbutanamide (PubChem CID 135300785) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-(1-hydroxypyrrolidin-3-yl)-3,3-dimethylbutanamide.

Molecular Properties

Compound NameN-(1-hydroxypyrrolidin-3-yl)-3,3-dimethylbutanamide
PubChem CID135300785
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-(1-hydroxypyrrolidin-3-yl)-3,3-dimethylbutanamide
SMILESCC(C)(C)CC(=O)NC1CCN(O)C1
InChIInChI=1S/C10H20N2O2/c1-10(2,3)6-9(13)11-8-4-5-12(14)7-8/h8,14H,4-7H2,1-3H3,(H,11,13)
InChIKeyTXHUASIKEYLMBY-UHFFFAOYSA-N
XLogP1.00
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-3,3-dimethylbutanamide
CID 110819893
N-[3-(3,3-dimethylbutanoylamino)cyclobutyl]-3,3-dimethylbutanamide
CID 159337962
ethyl 4-(3,3-dimethylbutanoylamino)piperidine-1-carboxylate
CID 110756025
4-(3,3-dimethylbutanoylamino)-N-propan-2-ylpiperidine-1-carboxamide
CID 110822375
3,3-dimethyl-N-[1-(3-methylbutanoyl)piperidin-4-yl]butanamide
CID 110819637
N-cyclopent-3-en-1-yl-3,3-dimethylbutanamide
CID 130669858
3,3-dimethyl-N-piperidin-4-ylbutanamide;hydrochloride
CID 53255531
3,3-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]butanamide
CID 170087380
3,3-dimethyl-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]butanamide
CID 110821216
N-(8-azabicyclo[3.2.1]octan-3-yl)-3,3-dimethylbutanamide;hydrochloride
CID 119455659
tert-butyl N-[4-(3,3-dimethylbutanoylamino)cyclohexyl]carbamate
CID 86277406
N-[(3R)-1-(2,2-dimethylpropyl)pyrrolidin-3-yl]acetamide
CID 58877738

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxypyrrolidin-3-yl)-3,3-dimethylbutanamide?
The IUPAC name of N-(1-hydroxypyrrolidin-3-yl)-3,3-dimethylbutanamide (CID 135300785) is N-(1-hydroxypyrrolidin-3-yl)-3,3-dimethylbutanamide.
What is the SMILES notation for N-(1-hydroxypyrrolidin-3-yl)-3,3-dimethylbutanamide?
The canonical SMILES for N-(1-hydroxypyrrolidin-3-yl)-3,3-dimethylbutanamide is CC(C)(C)CC(=O)NC1CCN(O)C1.
What is the InChIKey of N-(1-hydroxypyrrolidin-3-yl)-3,3-dimethylbutanamide?
The InChIKey is TXHUASIKEYLMBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-10(2,3)6-9(13)11-8-4-5-12(14)7-8/h8,14H,4-7H2,1-3H3,(H,11,13).
What are the key properties of N-(1-hydroxypyrrolidin-3-yl)-3,3-dimethylbutanamide?
N-(1-hydroxypyrrolidin-3-yl)-3,3-dimethylbutanamide has a molecular weight of 200.28 g/mol, XLogP of 1.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxypyrrolidin-3-yl)-3,3-dimethylbutanamide is sourced from PubChem (CID 135300785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).