2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]-N-cyclopropylacetamide

C22H34N2O2 — CID 24947607

IUPAC2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]-N-cyclopropylacetamide
SMILESO=C(CC1(CC(=O)NC2C3CC4CC(C3)CC2C4)CCCC1)NC1CC1
InChIInChI=1S/C22H34N2O2/c25-19(23-18-3-4-18)12-22(5-1-2-6-22)13-20(26)24-21-16-8-14-7-15(10-16)11-17(21)9-14/h14-18,21H,1-13H2,(H,23,25)(H,24,26)
InChIKeyAERMIKFZAAQFKH-UHFFFAOYSA-N
MW358.53 g/mol
LogP3.55
Rot. Bonds6

About 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]-N-cyclopropylacetamide

2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]-N-cyclopropylacetamide (PubChem CID 24947607) has the molecular formula C22H34N2O2 and a molecular weight of 358.53 g/mol. Its IUPAC name is 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]-N-cyclopropylacetamide
PubChem CID24947607
Molecular FormulaC22H34N2O2
Molecular Weight358.53 g/mol
Exact Mass358.26
IUPAC Name2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]-N-cyclopropylacetamide
SMILESO=C(CC1(CC(=O)NC2C3CC4CC(C3)CC2C4)CCCC1)NC1CC1
InChIInChI=1S/C22H34N2O2/c25-19(23-18-3-4-18)12-22(5-1-2-6-22)13-20(26)24-21-16-8-14-7-15(10-16)11-17(21)9-14/h14-18,21H,1-13H2,(H,23,25)(H,24,26)
InChIKeyAERMIKFZAAQFKH-UHFFFAOYSA-N
XLogP3.55
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.53
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-adamantyl)-N-cyclopropylacetamide
CID 5116038
N-Adamantan-2-yl-2-[1-(isobutylcarbamoyl-methyl)-cyclopentyl]-acetamide
CID 24825785
N-Adamantan-2-yl-2-[1-(2-oxo-2-pyrrolidin-1-yl-ethyl)-cyclopentyl]-acetamide
CID 24947608
3,3-Dimethyl-pentanedioic acid adamantan-2-ylamide cyclopropylamide
CID 24947610
N-Adamantan-2-yl-2-{1-[2-(4-ethyl-piperazin-1-yl)-2-oxo-ethyl]-cyclopentyl}-acetamide
CID 24947800
N-Adamantan-2-yl-2-(1-cyclopropylcarbamoylmethyl-cyclohexyl)-acetamide
CID 24947984
N-2-adamantylcyclopentanecarboxamide
CID 8178360
3,3-Dimethyl-pentanedioic acid(5-carbamoyl-adamantan-2-yl)-amide cyclopropylamide
CID 45272366
N'-[1-(1-adamantyl)ethyl]-N-(2-methylpropyl)pentanediamide
CID 164628811
Pentanedioic acid adamantan-2-ylamide cyclopropylamide
CID 45272362
N,N'-diisopropyl-1,3-adamantanedicarboxamide
CID 2882568
N'-(2-adamantyl)-N-(2-methylpropyl)pentanediamide
CID 164620519

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]-N-cyclopropylacetamide?
The IUPAC name of 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]-N-cyclopropylacetamide (CID 24947607) is 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]-N-cyclopropylacetamide?
The canonical SMILES for 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]-N-cyclopropylacetamide is O=C(CC1(CC(=O)NC2C3CC4CC(C3)CC2C4)CCCC1)NC1CC1.
What is the InChIKey of 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]-N-cyclopropylacetamide?
The InChIKey is AERMIKFZAAQFKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34N2O2/c25-19(23-18-3-4-18)12-22(5-1-2-6-22)13-20(26)24-21-16-8-14-7-15(10-16)11-17(21)9-14/h14-18,21H,1-13H2,(H,23,25)(H,24,26).
What are the key properties of 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]-N-cyclopropylacetamide?
2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]-N-cyclopropylacetamide has a molecular weight of 358.53 g/mol, XLogP of 3.55, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(2-adamantylamino)-2-oxoethyl]cyclopentyl]-N-cyclopropylacetamide is sourced from PubChem (CID 24947607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).