2-[4-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]butanamide

C19H28N2O2 — CID 3040614

IUPAC2-[4-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]butanamide
SMILESCCC(C(N)=O)C1(O)CCN(C2CCc3ccccc3C2)CC1
InChIInChI=1S/C19H28N2O2/c1-2-17(18(20)22)19(23)9-11-21(12-10-19)16-8-7-14-5-3-4-6-15(14)13-16/h3-6,16-17,23H,2,7-13H2,1H3,(H2,20,22)
InChIKeyVLEBMBYDUOAPKR-UHFFFAOYSA-N
MW316.44 g/mol
LogP1.88
Rot. Bonds4

About 2-[4-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]butanamide

2-[4-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]butanamide (PubChem CID 3040614) has the molecular formula C19H28N2O2 and a molecular weight of 316.44 g/mol. Its IUPAC name is 2-[4-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]butanamide.

Molecular Properties

Compound Name2-[4-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]butanamide
PubChem CID3040614
Molecular FormulaC19H28N2O2
Molecular Weight316.44 g/mol
Exact Mass316.22
IUPAC Name2-[4-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]butanamide
SMILESCCC(C(N)=O)C1(O)CCN(C2CCc3ccccc3C2)CC1
InChIInChI=1S/C19H28N2O2/c1-2-17(18(20)22)19(23)9-11-21(12-10-19)16-8-7-14-5-3-4-6-15(14)13-16/h3-6,16-17,23H,2,7-13H2,1H3,(H2,20,22)
InChIKeyVLEBMBYDUOAPKR-UHFFFAOYSA-N
XLogP1.88
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.44
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-Piperidinol, 4-acetyl-1-(1,2,3,4-tetrahydro-2-naphthyl)-
CID 218082
4-Piperidinol, 4-(1-aminopropyl)-1-(1,2,3,4-tetrahydro-2-naphthyl)-
CID 3040612
N-cyclohexyl-2-[4-hydroxy-1-(2-phenylethyl)piperidin-4-yl]-N-methylpropanamide;hydrochloride
CID 13061483
N-cyclohexyl-2-[4-hydroxy-1-[2-(4-methylphenyl)ethyl]piperidin-4-yl]-N-methylpropanamide;hydrochloride
CID 13061485
N-cyclohexyl-2-[1-[2-(2-fluorophenyl)ethyl]-4-hydroxypiperidin-4-yl]-N-methylpropanamide
CID 53692521
N-cyclohexyl-2-[1-(2-fluoro-2-phenylethyl)-4-hydroxypiperidin-4-yl]butanamide
CID 57164548
N-cyclohexyl-2-[4-hydroxy-1-(2-phenylethyl)piperidin-4-yl]-N-methylpropanamide
CID 13061482
N-cyclohexyl-2-[4-hydroxy-1-[2-(4-methylphenyl)ethyl]piperidin-4-yl]-N-methylpropanamide
CID 13061484
2-(4-hydroxy-1-phenethyl-4-piperidyl)-N,N-dimethyl propionamide
CID 20293505
2-[4-Hydroxy-1-(2-phenylethyl)piperidin-4-yl]-2-methylpropanamide
CID 54339476
2-[4-Hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide
CID 154414410
2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-N,N-dimethylpropanamide
CID 172748335

Frequently Asked Questions

What is the IUPAC name of 2-[4-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]butanamide?
The IUPAC name of 2-[4-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]butanamide (CID 3040614) is 2-[4-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]butanamide.
What is the SMILES notation for 2-[4-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]butanamide?
The canonical SMILES for 2-[4-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]butanamide is CCC(C(N)=O)C1(O)CCN(C2CCc3ccccc3C2)CC1.
What is the InChIKey of 2-[4-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]butanamide?
The InChIKey is VLEBMBYDUOAPKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O2/c1-2-17(18(20)22)19(23)9-11-21(12-10-19)16-8-7-14-5-3-4-6-15(14)13-16/h3-6,16-17,23H,2,7-13H2,1H3,(H2,20,22).
What are the key properties of 2-[4-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]butanamide?
2-[4-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]butanamide has a molecular weight of 316.44 g/mol, XLogP of 1.88, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-hydroxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]butanamide is sourced from PubChem (CID 3040614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).