(3R,5S)-3-hydroxy-5-methyl-N-propan-2-ylpiperidine-1-carboxamide

C10H20N2O2 — CID 130900909

IUPAC(3R,5S)-3-hydroxy-5-methyl-N-propan-2-ylpiperidine-1-carboxamide
SMILESCC(C)NC(=O)N1C[C@@H](C)C[C@@H](O)C1
InChIInChI=1S/C10H20N2O2/c1-7(2)11-10(14)12-5-8(3)4-9(13)6-12/h7-9,13H,4-6H2,1-3H3,(H,11,14)/t8-,9+/m0/s1
InChIKeyOZXBTFHGCUXZHT-DTWKUNHWSA-N
MW200.28 g/mol
LogP0.81
Rot. Bonds1

About (3R,5S)-3-hydroxy-5-methyl-N-propan-2-ylpiperidine-1-carboxamide

(3R,5S)-3-hydroxy-5-methyl-N-propan-2-ylpiperidine-1-carboxamide (PubChem CID 130900909) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is (3R,5S)-3-hydroxy-5-methyl-N-propan-2-ylpiperidine-1-carboxamide.

Molecular Properties

Compound Name(3R,5S)-3-hydroxy-5-methyl-N-propan-2-ylpiperidine-1-carboxamide
PubChem CID130900909
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name(3R,5S)-3-hydroxy-5-methyl-N-propan-2-ylpiperidine-1-carboxamide
SMILESCC(C)NC(=O)N1C[C@@H](C)C[C@@H](O)C1
InChIInChI=1S/C10H20N2O2/c1-7(2)11-10(14)12-5-8(3)4-9(13)6-12/h7-9,13H,4-6H2,1-3H3,(H,11,14)/t8-,9+/m0/s1
InChIKeyOZXBTFHGCUXZHT-DTWKUNHWSA-N
XLogP0.81
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R,5S)-3-hydroxy-5-methyl-N-propan-2-ylpiperidine-1-carboxamide?
The IUPAC name of (3R,5S)-3-hydroxy-5-methyl-N-propan-2-ylpiperidine-1-carboxamide (CID 130900909) is (3R,5S)-3-hydroxy-5-methyl-N-propan-2-ylpiperidine-1-carboxamide.
What is the SMILES notation for (3R,5S)-3-hydroxy-5-methyl-N-propan-2-ylpiperidine-1-carboxamide?
The canonical SMILES for (3R,5S)-3-hydroxy-5-methyl-N-propan-2-ylpiperidine-1-carboxamide is CC(C)NC(=O)N1C[C@@H](C)C[C@@H](O)C1.
What is the InChIKey of (3R,5S)-3-hydroxy-5-methyl-N-propan-2-ylpiperidine-1-carboxamide?
The InChIKey is OZXBTFHGCUXZHT-DTWKUNHWSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-7(2)11-10(14)12-5-8(3)4-9(13)6-12/h7-9,13H,4-6H2,1-3H3,(H,11,14)/t8-,9+/m0/s1.
What are the key properties of (3R,5S)-3-hydroxy-5-methyl-N-propan-2-ylpiperidine-1-carboxamide?
(3R,5S)-3-hydroxy-5-methyl-N-propan-2-ylpiperidine-1-carboxamide has a molecular weight of 200.28 g/mol, XLogP of 0.81, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,5S)-3-hydroxy-5-methyl-N-propan-2-ylpiperidine-1-carboxamide is sourced from PubChem (CID 130900909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).