(2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide

C10H20N2O — CID 99994089

IUPAC(2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide
SMILESC[C@@H]1C[C@H](C)CN([C@H](C)C(N)=O)C1
InChIInChI=1S/C10H20N2O/c1-7-4-8(2)6-12(5-7)9(3)10(11)13/h7-9H,4-6H2,1-3H3,(H2,11,13)/t7-,8+,9-/m1/s1
InChIKeyNEMZPKYPNPZWHB-HRDYMLBCSA-N
MW184.28 g/mol
LogP0.84
Rot. Bonds2

About (2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide

(2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide (PubChem CID 99994089) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is (2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide.

Molecular Properties

Compound Name(2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide
PubChem CID99994089
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name(2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide
SMILESC[C@@H]1C[C@H](C)CN([C@H](C)C(N)=O)C1
InChIInChI=1S/C10H20N2O/c1-7-4-8(2)6-12(5-7)9(3)10(11)13/h7-9H,4-6H2,1-3H3,(H2,11,13)/t7-,8+,9-/m1/s1
InChIKeyNEMZPKYPNPZWHB-HRDYMLBCSA-N
XLogP0.84
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]propanamide
CID 39257636
2-(3,5-dimethylpiperidin-1-yl)propanoic acid
CID 20985542
1,2-bis(3,5-dimethylpiperidin-1-yl)propan-1-one
CID 134062663
2-(2,6-dimethylmorpholin-4-yl)propanamide
CID 60644884
2-(1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl)propanamide
CID 130686441
2-(2-ethyl-4-methylpyrrolidin-1-yl)propanamide
CID 130855809
2-(3,5-dimethylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide
CID 51170713
2-[6-(dimethylamino)-3-azabicyclo[3.1.0]hexan-3-yl]propanamide
CID 130757921
2-(3,5-dimethylpiperidin-1-yl)-1-phenylpropan-1-one
CID 43227828
2-(3-amino-5-methylpiperidin-1-yl)-N-methylpropanamide
CID 79993684
2-[(3S)-3-methylpiperazin-1-yl]propanamide
CID 104976739
(2S)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]-3-methylbutanoic acid
CID 42234068

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide?
The IUPAC name of (2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide (CID 99994089) is (2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide.
What is the SMILES notation for (2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide?
The canonical SMILES for (2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide is C[C@@H]1C[C@H](C)CN([C@H](C)C(N)=O)C1.
What is the InChIKey of (2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide?
The InChIKey is NEMZPKYPNPZWHB-HRDYMLBCSA-N. The full InChI is InChI=1S/C10H20N2O/c1-7-4-8(2)6-12(5-7)9(3)10(11)13/h7-9H,4-6H2,1-3H3,(H2,11,13)/t7-,8+,9-/m1/s1.
What are the key properties of (2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide?
(2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide has a molecular weight of 184.28 g/mol, XLogP of 0.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]propanamide is sourced from PubChem (CID 99994089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).