3-hydroxy-1-piperidin-4-yl-N-propan-2-ylpiperidine-3-carboxamide

C14H27N3O2 — CID 71104082

IUPAC3-hydroxy-1-piperidin-4-yl-N-propan-2-ylpiperidine-3-carboxamide
SMILESCC(C)NC(=O)C1(O)CCCN(C2CCNCC2)C1
InChIInChI=1S/C14H27N3O2/c1-11(2)16-13(18)14(19)6-3-9-17(10-14)12-4-7-15-8-5-12/h11-12,15,19H,3-10H2,1-2H3,(H,16,18)
InChIKeyIHDCQZGPJAJLSJ-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.09
Rot. Bonds3

About 3-hydroxy-1-piperidin-4-yl-N-propan-2-ylpiperidine-3-carboxamide

3-hydroxy-1-piperidin-4-yl-N-propan-2-ylpiperidine-3-carboxamide (PubChem CID 71104082) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 3-hydroxy-1-piperidin-4-yl-N-propan-2-ylpiperidine-3-carboxamide.

Molecular Properties

Compound Name3-hydroxy-1-piperidin-4-yl-N-propan-2-ylpiperidine-3-carboxamide
PubChem CID71104082
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name3-hydroxy-1-piperidin-4-yl-N-propan-2-ylpiperidine-3-carboxamide
SMILESCC(C)NC(=O)C1(O)CCCN(C2CCNCC2)C1
InChIInChI=1S/C14H27N3O2/c1-11(2)16-13(18)14(19)6-3-9-17(10-14)12-4-7-15-8-5-12/h11-12,15,19H,3-10H2,1-2H3,(H,16,18)
InChIKeyIHDCQZGPJAJLSJ-UHFFFAOYSA-N
XLogP0.09
TPSA64.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-1-piperidin-4-yl-N-propan-2-ylpiperidine-3-carboxamide?
The IUPAC name of 3-hydroxy-1-piperidin-4-yl-N-propan-2-ylpiperidine-3-carboxamide (CID 71104082) is 3-hydroxy-1-piperidin-4-yl-N-propan-2-ylpiperidine-3-carboxamide.
What is the SMILES notation for 3-hydroxy-1-piperidin-4-yl-N-propan-2-ylpiperidine-3-carboxamide?
The canonical SMILES for 3-hydroxy-1-piperidin-4-yl-N-propan-2-ylpiperidine-3-carboxamide is CC(C)NC(=O)C1(O)CCCN(C2CCNCC2)C1.
What is the InChIKey of 3-hydroxy-1-piperidin-4-yl-N-propan-2-ylpiperidine-3-carboxamide?
The InChIKey is IHDCQZGPJAJLSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-11(2)16-13(18)14(19)6-3-9-17(10-14)12-4-7-15-8-5-12/h11-12,15,19H,3-10H2,1-2H3,(H,16,18).
What are the key properties of 3-hydroxy-1-piperidin-4-yl-N-propan-2-ylpiperidine-3-carboxamide?
3-hydroxy-1-piperidin-4-yl-N-propan-2-ylpiperidine-3-carboxamide has a molecular weight of 269.39 g/mol, XLogP of 0.09, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-1-piperidin-4-yl-N-propan-2-ylpiperidine-3-carboxamide is sourced from PubChem (CID 71104082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).