[2-(2-hydroxyethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone

C16H20N2O2 — CID 43421689

IUPAC[2-(2-hydroxyethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone
SMILESO=C(c1cc2ccccc2[nH]1)N1CCCCC1CCO
InChIInChI=1S/C16H20N2O2/c19-10-8-13-6-3-4-9-18(13)16(20)15-11-12-5-1-2-7-14(12)17-15/h1-2,5,7,11,13,17,19H,3-4,6,8-10H2
InChIKeyBDOZGZHUMMDMKH-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.55
Rot. Bonds3

About [2-(2-hydroxyethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone

[2-(2-hydroxyethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone (PubChem CID 43421689) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is [2-(2-hydroxyethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone.

Molecular Properties

Compound Name[2-(2-hydroxyethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone
PubChem CID43421689
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name[2-(2-hydroxyethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone
SMILESO=C(c1cc2ccccc2[nH]1)N1CCCCC1CCO
InChIInChI=1S/C16H20N2O2/c19-10-8-13-6-3-4-9-18(13)16(20)15-11-12-5-1-2-7-14(12)17-15/h1-2,5,7,11,13,17,19H,3-4,6,8-10H2
InChIKeyBDOZGZHUMMDMKH-UHFFFAOYSA-N
XLogP2.55
TPSA56.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(2-hydroxyethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone?
The IUPAC name of [2-(2-hydroxyethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone (CID 43421689) is [2-(2-hydroxyethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone.
What is the SMILES notation for [2-(2-hydroxyethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone?
The canonical SMILES for [2-(2-hydroxyethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone is O=C(c1cc2ccccc2[nH]1)N1CCCCC1CCO.
What is the InChIKey of [2-(2-hydroxyethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone?
The InChIKey is BDOZGZHUMMDMKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c19-10-8-13-6-3-4-9-18(13)16(20)15-11-12-5-1-2-7-14(12)17-15/h1-2,5,7,11,13,17,19H,3-4,6,8-10H2.
What are the key properties of [2-(2-hydroxyethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone?
[2-(2-hydroxyethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone has a molecular weight of 272.35 g/mol, XLogP of 2.55, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-hydroxyethyl)piperidin-1-yl]-(1H-indol-2-yl)methanone is sourced from PubChem (CID 43421689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).