2-(1-adamantyl)-N-(1-piperidin-3-ylethyl)acetamide

C19H32N2O — CID 119474052

IUPAC2-(1-adamantyl)-N-(1-piperidin-3-ylethyl)acetamide
SMILESCC(NC(=O)CC12CC3CC(CC(C3)C1)C2)C1CCCNC1
InChIInChI=1S/C19H32N2O/c1-13(17-3-2-4-20-12-17)21-18(22)11-19-8-14-5-15(9-19)7-16(6-14)10-19/h13-17,20H,2-12H2,1H3,(H,21,22)
InChIKeyRCFVBFOHPILRMN-UHFFFAOYSA-N
MW304.48 g/mol
LogP3.10
Rot. Bonds4

About 2-(1-adamantyl)-N-(1-piperidin-3-ylethyl)acetamide

2-(1-adamantyl)-N-(1-piperidin-3-ylethyl)acetamide (PubChem CID 119474052) has the molecular formula C19H32N2O and a molecular weight of 304.48 g/mol. Its IUPAC name is 2-(1-adamantyl)-N-(1-piperidin-3-ylethyl)acetamide.

Molecular Properties

Compound Name2-(1-adamantyl)-N-(1-piperidin-3-ylethyl)acetamide
PubChem CID119474052
Molecular FormulaC19H32N2O
Molecular Weight304.48 g/mol
Exact Mass304.25
IUPAC Name2-(1-adamantyl)-N-(1-piperidin-3-ylethyl)acetamide
SMILESCC(NC(=O)CC12CC3CC(CC(C3)C1)C2)C1CCCNC1
InChIInChI=1S/C19H32N2O/c1-13(17-3-2-4-20-12-17)21-18(22)11-19-8-14-5-15(9-19)7-16(6-14)10-19/h13-17,20H,2-12H2,1H3,(H,21,22)
InChIKeyRCFVBFOHPILRMN-UHFFFAOYSA-N
XLogP3.10
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.48
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclobutyl-N-(1-piperidin-3-ylethyl)acetamide
CID 103806063
2-cycloheptyl-N-(1-piperidin-3-ylethyl)acetamide
CID 115736930
3,4,4-trimethyl-N-(1-piperidin-3-ylethyl)pentanamide
CID 63834825
1-(1-piperidin-3-ylethyl)-3-propan-2-ylurea
CID 43523388
N-(1-piperidin-3-ylethyl)cyclopentanecarboxamide
CID 43523140
N-[(1R)-1-cyclopentylethyl]-3-piperidin-3-ylpropanamide
CID 81390288
2-(4-hydroxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide
CID 62046897
2-amino-N-(1-piperidin-3-ylethyl)propanamide
CID 131134166
(2R)-2-amino-N-(1-piperidin-3-ylethyl)propanamide
CID 131038230
1-(1-piperidin-3-ylethyl)-3-propylurea
CID 43523385
2-(1-adamantyl)-N-[(1R)-1-(1-adamantyl)ethyl]acetamide
CID 7322047
2-(1-adamantyl)-N-[(2R)-1-hydroxypropan-2-yl]acetamide
CID 79030779

Frequently Asked Questions

What is the IUPAC name of 2-(1-adamantyl)-N-(1-piperidin-3-ylethyl)acetamide?
The IUPAC name of 2-(1-adamantyl)-N-(1-piperidin-3-ylethyl)acetamide (CID 119474052) is 2-(1-adamantyl)-N-(1-piperidin-3-ylethyl)acetamide.
What is the SMILES notation for 2-(1-adamantyl)-N-(1-piperidin-3-ylethyl)acetamide?
The canonical SMILES for 2-(1-adamantyl)-N-(1-piperidin-3-ylethyl)acetamide is CC(NC(=O)CC12CC3CC(CC(C3)C1)C2)C1CCCNC1.
What is the InChIKey of 2-(1-adamantyl)-N-(1-piperidin-3-ylethyl)acetamide?
The InChIKey is RCFVBFOHPILRMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2O/c1-13(17-3-2-4-20-12-17)21-18(22)11-19-8-14-5-15(9-19)7-16(6-14)10-19/h13-17,20H,2-12H2,1H3,(H,21,22).
What are the key properties of 2-(1-adamantyl)-N-(1-piperidin-3-ylethyl)acetamide?
2-(1-adamantyl)-N-(1-piperidin-3-ylethyl)acetamide has a molecular weight of 304.48 g/mol, XLogP of 3.10, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-adamantyl)-N-(1-piperidin-3-ylethyl)acetamide is sourced from PubChem (CID 119474052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).