(3R)-3-hydroxy-N,N-di(propan-2-yl)butanamide

C10H21NO2 — CID 162405135

IUPAC(3R)-3-hydroxy-N,N-di(propan-2-yl)butanamide
SMILESCC(C)N(C(=O)C[C@@H](C)O)C(C)C
InChIInChI=1S/C10H21NO2/c1-7(2)11(8(3)4)10(13)6-9(5)12/h7-9,12H,6H2,1-5H3/t9-/m1/s1
InChIKeyTVIVWHXTLYGUKA-SECBINFHSA-N
MW187.28 g/mol
LogP1.40
Rot. Bonds4

About (3R)-3-hydroxy-N,N-di(propan-2-yl)butanamide

(3R)-3-hydroxy-N,N-di(propan-2-yl)butanamide (PubChem CID 162405135) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is (3R)-3-hydroxy-N,N-di(propan-2-yl)butanamide.

Molecular Properties

Compound Name(3R)-3-hydroxy-N,N-di(propan-2-yl)butanamide
PubChem CID162405135
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name(3R)-3-hydroxy-N,N-di(propan-2-yl)butanamide
SMILESCC(C)N(C(=O)C[C@@H](C)O)C(C)C
InChIInChI=1S/C10H21NO2/c1-7(2)11(8(3)4)10(13)6-9(5)12/h7-9,12H,6H2,1-5H3/t9-/m1/s1
InChIKeyTVIVWHXTLYGUKA-SECBINFHSA-N
XLogP1.40
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-hydroxy-N,N-di(propan-2-yl)butanamide?
The IUPAC name of (3R)-3-hydroxy-N,N-di(propan-2-yl)butanamide (CID 162405135) is (3R)-3-hydroxy-N,N-di(propan-2-yl)butanamide.
What is the SMILES notation for (3R)-3-hydroxy-N,N-di(propan-2-yl)butanamide?
The canonical SMILES for (3R)-3-hydroxy-N,N-di(propan-2-yl)butanamide is CC(C)N(C(=O)C[C@@H](C)O)C(C)C.
What is the InChIKey of (3R)-3-hydroxy-N,N-di(propan-2-yl)butanamide?
The InChIKey is TVIVWHXTLYGUKA-SECBINFHSA-N. The full InChI is InChI=1S/C10H21NO2/c1-7(2)11(8(3)4)10(13)6-9(5)12/h7-9,12H,6H2,1-5H3/t9-/m1/s1.
What are the key properties of (3R)-3-hydroxy-N,N-di(propan-2-yl)butanamide?
(3R)-3-hydroxy-N,N-di(propan-2-yl)butanamide has a molecular weight of 187.28 g/mol, XLogP of 1.40, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-hydroxy-N,N-di(propan-2-yl)butanamide is sourced from PubChem (CID 162405135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).