N-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride

C14H27ClN2O — CID 119725744

IUPACN-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
SMILESCl.O=C(CC1CCCN1)NCCC1CCCCC1
InChIInChI=1S/C14H26N2O.ClH/c17-14(11-13-7-4-9-15-13)16-10-8-12-5-2-1-3-6-12;/h12-13,15H,1-11H2,(H,16,17);1H
InChIKeyZXUHHIXXVNDLKX-UHFFFAOYSA-N
MW274.84 g/mol
LogP2.64
Rot. Bonds5

About N-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride

N-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride (PubChem CID 119725744) has the molecular formula C14H27ClN2O and a molecular weight of 274.84 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
PubChem CID119725744
Molecular FormulaC14H27ClN2O
Molecular Weight274.84 g/mol
Exact Mass274.18
IUPAC NameN-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
SMILESCl.O=C(CC1CCCN1)NCCC1CCCCC1
InChIInChI=1S/C14H26N2O.ClH/c17-14(11-13-7-4-9-15-13)16-10-8-12-5-2-1-3-6-12;/h12-13,15H,1-11H2,(H,16,17);1H
InChIKeyZXUHHIXXVNDLKX-UHFFFAOYSA-N
XLogP2.64
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.84
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyclohexylethyl)-2-piperidin-2-ylacetamide
CID 54932758
N-[2-(1-methylpiperidin-4-yl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 113267487
N-(2-cyclohexylethyl)-3-piperidin-2-ylpropanamide
CID 62210016
N-(cyclopentylmethyl)-2-pyrrolidin-2-ylacetamide
CID 61370022
N-(2-cyclohexylethyl)-2-(4-methylpiperazin-2-yl)acetamide
CID 115178336
2-pyrrolidin-2-yl-N-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]acetamide
CID 119898449
N-(cyclobutylmethyl)-2-pyrrolidin-2-ylacetamide
CID 61372732
2-pyrrolidin-2-yl-N-(4,4,4-trifluorobutyl)acetamide;hydrochloride
CID 119781580
N-(2-cyclohexyloxyethyl)-2-pyrrolidin-2-ylacetamide
CID 63826362
2-cyclohexyl-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
CID 119260693
2-cycloheptyl-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
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N-(3-aminopropyl)-2-pyrrolidin-2-ylacetamide
CID 61366460

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride?
The IUPAC name of N-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride (CID 119725744) is N-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride.
What is the SMILES notation for N-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride?
The canonical SMILES for N-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride is Cl.O=C(CC1CCCN1)NCCC1CCCCC1.
What is the InChIKey of N-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride?
The InChIKey is ZXUHHIXXVNDLKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O.ClH/c17-14(11-13-7-4-9-15-13)16-10-8-12-5-2-1-3-6-12;/h12-13,15H,1-11H2,(H,16,17);1H.
What are the key properties of N-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride?
N-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride has a molecular weight of 274.84 g/mol, XLogP of 2.64, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)-2-pyrrolidin-2-ylacetamide;hydrochloride is sourced from PubChem (CID 119725744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).