3-methyl-1-propan-2-ylpiperidin-3-ol

C9H19NO — CID 69087871

IUPAC3-methyl-1-propan-2-ylpiperidin-3-ol
SMILESCC(C)N1CCCC(C)(O)C1
InChIInChI=1S/C9H19NO/c1-8(2)10-6-4-5-9(3,11)7-10/h8,11H,4-7H2,1-3H3
InChIKeyIUGBXVMPSOBKHP-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.24
Rot. Bonds1

About 3-methyl-1-propan-2-ylpiperidin-3-ol

3-methyl-1-propan-2-ylpiperidin-3-ol (PubChem CID 69087871) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 3-methyl-1-propan-2-ylpiperidin-3-ol.

Molecular Properties

Compound Name3-methyl-1-propan-2-ylpiperidin-3-ol
PubChem CID69087871
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name3-methyl-1-propan-2-ylpiperidin-3-ol
SMILESCC(C)N1CCCC(C)(O)C1
InChIInChI=1S/C9H19NO/c1-8(2)10-6-4-5-9(3,11)7-10/h8,11H,4-7H2,1-3H3
InChIKeyIUGBXVMPSOBKHP-UHFFFAOYSA-N
XLogP1.24
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-propan-2-ylpiperidin-3-ol?
The IUPAC name of 3-methyl-1-propan-2-ylpiperidin-3-ol (CID 69087871) is 3-methyl-1-propan-2-ylpiperidin-3-ol.
What is the SMILES notation for 3-methyl-1-propan-2-ylpiperidin-3-ol?
The canonical SMILES for 3-methyl-1-propan-2-ylpiperidin-3-ol is CC(C)N1CCCC(C)(O)C1.
What is the InChIKey of 3-methyl-1-propan-2-ylpiperidin-3-ol?
The InChIKey is IUGBXVMPSOBKHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-8(2)10-6-4-5-9(3,11)7-10/h8,11H,4-7H2,1-3H3.
What are the key properties of 3-methyl-1-propan-2-ylpiperidin-3-ol?
3-methyl-1-propan-2-ylpiperidin-3-ol has a molecular weight of 157.26 g/mol, XLogP of 1.24, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-propan-2-ylpiperidin-3-ol is sourced from PubChem (CID 69087871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).