(3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide

C11H21NO3 — CID 11095992

IUPAC(3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide
SMILESCON(C)C(=O)C[C@@H](C)[C@@H]1CC[C@H](O)C1
InChIInChI=1S/C11H21NO3/c1-8(6-11(14)12(2)15-3)9-4-5-10(13)7-9/h8-10,13H,4-7H2,1-3H3/t8-,9-,10+/m1/s1
InChIKeyDKUBCOUWQSDTNC-BBBLOLIVSA-N
MW215.29 g/mol
LogP1.19
Rot. Bonds4

About (3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide

(3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide (PubChem CID 11095992) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is (3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide.

Molecular Properties

Compound Name(3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide
PubChem CID11095992
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Name(3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide
SMILESCON(C)C(=O)C[C@@H](C)[C@@H]1CC[C@H](O)C1
InChIInChI=1S/C11H21NO3/c1-8(6-11(14)12(2)15-3)9-4-5-10(13)7-9/h8-10,13H,4-7H2,1-3H3/t8-,9-,10+/m1/s1
InChIKeyDKUBCOUWQSDTNC-BBBLOLIVSA-N
XLogP1.19
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-methoxy-N,3-dimethylbutanamide
CID 10975620
3-hydroxy-N-methoxy-N-methylbutanamide
CID 73159357
N-methoxy-N-methyl-2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)acetamide
CID 59808791
ethyl 3-cyclopropylbutanoate
CID 47078610
2-cyclopentyl-N-methoxy-N-methylacetamide
CID 15158208
N,N-bis(2-methoxyethyl)-3-piperidin-4-ylbutanamide
CID 119672639
(3R)-4,4,4-trichloro-3-hydroxy-N-methoxy-N-methylbutanamide
CID 11543342
(3R)-3-hydroxy-N-methoxy-N-methylpent-4-enamide
CID 25259472
N-(dicyclopropylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119760613
N-methoxy-N-methylpropanamide
CID 11344007
N-methoxy-N-methyl-3-phenylbutanamide
CID 22612044
3-cyclobutyl-N-methoxy-N-methylpropanamide
CID 142020643

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide?
The IUPAC name of (3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide (CID 11095992) is (3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide.
What is the SMILES notation for (3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide?
The canonical SMILES for (3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide is CON(C)C(=O)C[C@@H](C)[C@@H]1CC[C@H](O)C1.
What is the InChIKey of (3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide?
The InChIKey is DKUBCOUWQSDTNC-BBBLOLIVSA-N. The full InChI is InChI=1S/C11H21NO3/c1-8(6-11(14)12(2)15-3)9-4-5-10(13)7-9/h8-10,13H,4-7H2,1-3H3/t8-,9-,10+/m1/s1.
What are the key properties of (3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide?
(3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide has a molecular weight of 215.29 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide is sourced from PubChem (CID 11095992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).