2-[4-[(7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]acetamide

C20H31N3O — CID 75434892

IUPAC2-[4-[(7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]acetamide
SMILESCC(C)c1ccc2c(c1)C(NC1CCN(CC(N)=O)CC1)CCC2
InChIInChI=1S/C20H31N3O/c1-14(2)16-7-6-15-4-3-5-19(18(15)12-16)22-17-8-10-23(11-9-17)13-20(21)24/h6-7,12,14,17,19,22H,3-5,8-11,13H2,1-2H3,(H2,21,24)
InChIKeyLJLRPMZTVHHRJD-UHFFFAOYSA-N
MW329.49 g/mol
LogP2.73
Rot. Bonds5

About 2-[4-[(7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]acetamide

2-[4-[(7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]acetamide (PubChem CID 75434892) has the molecular formula C20H31N3O and a molecular weight of 329.49 g/mol. Its IUPAC name is 2-[4-[(7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[(7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]acetamide
PubChem CID75434892
Molecular FormulaC20H31N3O
Molecular Weight329.49 g/mol
Exact Mass329.25
IUPAC Name2-[4-[(7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]acetamide
SMILESCC(C)c1ccc2c(c1)C(NC1CCN(CC(N)=O)CC1)CCC2
InChIInChI=1S/C20H31N3O/c1-14(2)16-7-6-15-4-3-5-19(18(15)12-16)22-17-8-10-23(11-9-17)13-20(21)24/h6-7,12,14,17,19,22H,3-5,8-11,13H2,1-2H3,(H2,21,24)
InChIKeyLJLRPMZTVHHRJD-UHFFFAOYSA-N
XLogP2.73
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.49
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[(7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-[(7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]acetamide (CID 75434892) is 2-[4-[(7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-[(7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-[(7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]acetamide is CC(C)c1ccc2c(c1)C(NC1CCN(CC(N)=O)CC1)CCC2.
What is the InChIKey of 2-[4-[(7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]acetamide?
The InChIKey is LJLRPMZTVHHRJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N3O/c1-14(2)16-7-6-15-4-3-5-19(18(15)12-16)22-17-8-10-23(11-9-17)13-20(21)24/h6-7,12,14,17,19,22H,3-5,8-11,13H2,1-2H3,(H2,21,24).
What are the key properties of 2-[4-[(7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]acetamide?
2-[4-[(7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]acetamide has a molecular weight of 329.49 g/mol, XLogP of 2.73, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(7-propan-2-yl-1,2,3,4-tetrahydronaphthalen-1-yl)amino]piperidin-1-yl]acetamide is sourced from PubChem (CID 75434892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).