N-(1-cyclopropylpiperidin-4-yl)-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide

C19H26N2O2 — CID 48691425

IUPACN-(1-cyclopropylpiperidin-4-yl)-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide
SMILESO=C(NC1CCN(C2CC2)CC1)c1cc2c(cc1O)CCCC2
InChIInChI=1S/C19H26N2O2/c22-18-12-14-4-2-1-3-13(14)11-17(18)19(23)20-15-7-9-21(10-8-15)16-5-6-16/h11-12,15-16,22H,1-10H2,(H,20,23)
InChIKeyIJUTWUGLHKVMJE-UHFFFAOYSA-N
MW314.43 g/mol
LogP2.63
Rot. Bonds3

About N-(1-cyclopropylpiperidin-4-yl)-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide

N-(1-cyclopropylpiperidin-4-yl)-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide (PubChem CID 48691425) has the molecular formula C19H26N2O2 and a molecular weight of 314.43 g/mol. Its IUPAC name is N-(1-cyclopropylpiperidin-4-yl)-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropylpiperidin-4-yl)-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide
PubChem CID48691425
Molecular FormulaC19H26N2O2
Molecular Weight314.43 g/mol
Exact Mass314.20
IUPAC NameN-(1-cyclopropylpiperidin-4-yl)-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide
SMILESO=C(NC1CCN(C2CC2)CC1)c1cc2c(cc1O)CCCC2
InChIInChI=1S/C19H26N2O2/c22-18-12-14-4-2-1-3-13(14)11-17(18)19(23)20-15-7-9-21(10-8-15)16-5-6-16/h11-12,15-16,22H,1-10H2,(H,20,23)
InChIKeyIJUTWUGLHKVMJE-UHFFFAOYSA-N
XLogP2.63
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpiperidin-4-yl)-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The IUPAC name of N-(1-cyclopropylpiperidin-4-yl)-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide (CID 48691425) is N-(1-cyclopropylpiperidin-4-yl)-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide.
What is the SMILES notation for N-(1-cyclopropylpiperidin-4-yl)-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The canonical SMILES for N-(1-cyclopropylpiperidin-4-yl)-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide is O=C(NC1CCN(C2CC2)CC1)c1cc2c(cc1O)CCCC2.
What is the InChIKey of N-(1-cyclopropylpiperidin-4-yl)-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The InChIKey is IJUTWUGLHKVMJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O2/c22-18-12-14-4-2-1-3-13(14)11-17(18)19(23)20-15-7-9-21(10-8-15)16-5-6-16/h11-12,15-16,22H,1-10H2,(H,20,23).
What are the key properties of N-(1-cyclopropylpiperidin-4-yl)-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
N-(1-cyclopropylpiperidin-4-yl)-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide has a molecular weight of 314.43 g/mol, XLogP of 2.63, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpiperidin-4-yl)-3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide is sourced from PubChem (CID 48691425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).