2,2-dimethyl-3-[(3R)-1-(1-methylcyclopentanecarbonyl)piperidin-3-yl]propanamide

C17H30N2O2 — CID 164640577

IUPAC2,2-dimethyl-3-[(3R)-1-(1-methylcyclopentanecarbonyl)piperidin-3-yl]propanamide
SMILESCC(C)(C[C@H]1CCCN(C(=O)C2(C)CCCC2)C1)C(N)=O
InChIInChI=1S/C17H30N2O2/c1-16(2,14(18)20)11-13-7-6-10-19(12-13)15(21)17(3)8-4-5-9-17/h13H,4-12H2,1-3H3,(H2,18,20)/t13-/m1/s1
InChIKeyDOCYQYOZZKRJMV-CYBMUJFWSA-N
MW294.44 g/mol
LogP2.71
Rot. Bonds4

About 2,2-dimethyl-3-[(3R)-1-(1-methylcyclopentanecarbonyl)piperidin-3-yl]propanamide

2,2-dimethyl-3-[(3R)-1-(1-methylcyclopentanecarbonyl)piperidin-3-yl]propanamide (PubChem CID 164640577) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is 2,2-dimethyl-3-[(3R)-1-(1-methylcyclopentanecarbonyl)piperidin-3-yl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-3-[(3R)-1-(1-methylcyclopentanecarbonyl)piperidin-3-yl]propanamide
PubChem CID164640577
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC Name2,2-dimethyl-3-[(3R)-1-(1-methylcyclopentanecarbonyl)piperidin-3-yl]propanamide
SMILESCC(C)(C[C@H]1CCCN(C(=O)C2(C)CCCC2)C1)C(N)=O
InChIInChI=1S/C17H30N2O2/c1-16(2,14(18)20)11-13-7-6-10-19(12-13)15(21)17(3)8-4-5-9-17/h13H,4-12H2,1-3H3,(H2,18,20)/t13-/m1/s1
InChIKeyDOCYQYOZZKRJMV-CYBMUJFWSA-N
XLogP2.71
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-[(3R)-1-(1-methylcyclopentanecarbonyl)piperidin-3-yl]propanamide?
The IUPAC name of 2,2-dimethyl-3-[(3R)-1-(1-methylcyclopentanecarbonyl)piperidin-3-yl]propanamide (CID 164640577) is 2,2-dimethyl-3-[(3R)-1-(1-methylcyclopentanecarbonyl)piperidin-3-yl]propanamide.
What is the SMILES notation for 2,2-dimethyl-3-[(3R)-1-(1-methylcyclopentanecarbonyl)piperidin-3-yl]propanamide?
The canonical SMILES for 2,2-dimethyl-3-[(3R)-1-(1-methylcyclopentanecarbonyl)piperidin-3-yl]propanamide is CC(C)(C[C@H]1CCCN(C(=O)C2(C)CCCC2)C1)C(N)=O.
What is the InChIKey of 2,2-dimethyl-3-[(3R)-1-(1-methylcyclopentanecarbonyl)piperidin-3-yl]propanamide?
The InChIKey is DOCYQYOZZKRJMV-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-16(2,14(18)20)11-13-7-6-10-19(12-13)15(21)17(3)8-4-5-9-17/h13H,4-12H2,1-3H3,(H2,18,20)/t13-/m1/s1.
What are the key properties of 2,2-dimethyl-3-[(3R)-1-(1-methylcyclopentanecarbonyl)piperidin-3-yl]propanamide?
2,2-dimethyl-3-[(3R)-1-(1-methylcyclopentanecarbonyl)piperidin-3-yl]propanamide has a molecular weight of 294.44 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-[(3R)-1-(1-methylcyclopentanecarbonyl)piperidin-3-yl]propanamide is sourced from PubChem (CID 164640577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).