2-[3-[1-(cyclopropylmethyl)piperidin-2-yl]-1,2-oxazol-5-yl]ethanol

C14H22N2O2 — CID 73440537

IUPAC2-[3-[1-(cyclopropylmethyl)piperidin-2-yl]-1,2-oxazol-5-yl]ethanol
SMILESOCCc1cc(C2CCCCN2CC2CC2)no1
InChIInChI=1S/C14H22N2O2/c17-8-6-12-9-13(15-18-12)14-3-1-2-7-16(14)10-11-4-5-11/h9,11,14,17H,1-8,10H2
InChIKeyWQVDCHSGQPFFCK-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.15
Rot. Bonds5

About 2-[3-[1-(cyclopropylmethyl)piperidin-2-yl]-1,2-oxazol-5-yl]ethanol

2-[3-[1-(cyclopropylmethyl)piperidin-2-yl]-1,2-oxazol-5-yl]ethanol (PubChem CID 73440537) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-[3-[1-(cyclopropylmethyl)piperidin-2-yl]-1,2-oxazol-5-yl]ethanol.

Molecular Properties

Compound Name2-[3-[1-(cyclopropylmethyl)piperidin-2-yl]-1,2-oxazol-5-yl]ethanol
PubChem CID73440537
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-[3-[1-(cyclopropylmethyl)piperidin-2-yl]-1,2-oxazol-5-yl]ethanol
SMILESOCCc1cc(C2CCCCN2CC2CC2)no1
InChIInChI=1S/C14H22N2O2/c17-8-6-12-9-13(15-18-12)14-3-1-2-7-16(14)10-11-4-5-11/h9,11,14,17H,1-8,10H2
InChIKeyWQVDCHSGQPFFCK-UHFFFAOYSA-N
XLogP2.15
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[3-[1-(cyclopropylmethyl)piperidin-2-yl]-1,2-oxazol-5-yl]ethanol?
The IUPAC name of 2-[3-[1-(cyclopropylmethyl)piperidin-2-yl]-1,2-oxazol-5-yl]ethanol (CID 73440537) is 2-[3-[1-(cyclopropylmethyl)piperidin-2-yl]-1,2-oxazol-5-yl]ethanol.
What is the SMILES notation for 2-[3-[1-(cyclopropylmethyl)piperidin-2-yl]-1,2-oxazol-5-yl]ethanol?
The canonical SMILES for 2-[3-[1-(cyclopropylmethyl)piperidin-2-yl]-1,2-oxazol-5-yl]ethanol is OCCc1cc(C2CCCCN2CC2CC2)no1.
What is the InChIKey of 2-[3-[1-(cyclopropylmethyl)piperidin-2-yl]-1,2-oxazol-5-yl]ethanol?
The InChIKey is WQVDCHSGQPFFCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c17-8-6-12-9-13(15-18-12)14-3-1-2-7-16(14)10-11-4-5-11/h9,11,14,17H,1-8,10H2.
What are the key properties of 2-[3-[1-(cyclopropylmethyl)piperidin-2-yl]-1,2-oxazol-5-yl]ethanol?
2-[3-[1-(cyclopropylmethyl)piperidin-2-yl]-1,2-oxazol-5-yl]ethanol has a molecular weight of 250.34 g/mol, XLogP of 2.15, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[1-(cyclopropylmethyl)piperidin-2-yl]-1,2-oxazol-5-yl]ethanol is sourced from PubChem (CID 73440537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).