N-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide

C11H20N2O — CID 79279826

IUPACN-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide
SMILESC=CCNCC(=O)NC1(C)CCCC1
InChIInChI=1S/C11H20N2O/c1-3-8-12-9-10(14)13-11(2)6-4-5-7-11/h3,12H,1,4-9H2,2H3,(H,13,14)
InChIKeyJXTRAFQPLNSWPA-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.21
Rot. Bonds5

About N-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide

N-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide (PubChem CID 79279826) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide.

Molecular Properties

Compound NameN-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide
PubChem CID79279826
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide
SMILESC=CCNCC(=O)NC1(C)CCCC1
InChIInChI=1S/C11H20N2O/c1-3-8-12-9-10(14)13-11(2)6-4-5-7-11/h3,12H,1,4-9H2,2H3,(H,13,14)
InChIKeyJXTRAFQPLNSWPA-UHFFFAOYSA-N
XLogP1.21
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-[1-(hydroxymethyl)cyclohexyl]-2-(prop-2-enylamino)acetamide
CID 79278936
2-(2-methoxyethylamino)-N-(1-methylcyclopentyl)acetamide
CID 79282104
N-(1-methylcyclopropyl)pent-4-enamide
CID 131210257
N-(1-methylcyclobutyl)propanamide
CID 115766065
2-(2-methoxyethylamino)-N-(1-methylcyclohexyl)acetamide;hydrochloride
CID 119736484
N-(1-methylcyclopentyl)-2-methylsulfanylacetamide
CID 131154660
1-[[[2-(prop-2-enylamino)acetyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 115436444
1-(3,3-dimethylpiperidin-1-yl)-2-(prop-2-enylamino)ethanone
CID 79280233
1-methyl-2-[[2-(prop-2-enylamino)acetyl]amino]cyclopentane-1-carboxylic acid
CID 82763385
N-[(1R)-1-cyclopentylethyl]-2-(prop-2-enylamino)acetamide
CID 81388659
N-[(1S)-1-cyclopentylethyl]-2-(prop-2-enylamino)acetamide
CID 81388626
(2R)-2-[[2-(prop-2-enylamino)acetyl]amino]propanoic acid
CID 79278714

Frequently Asked Questions

What is the IUPAC name of N-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide?
The IUPAC name of N-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide (CID 79279826) is N-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide.
What is the SMILES notation for N-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide?
The canonical SMILES for N-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide is C=CCNCC(=O)NC1(C)CCCC1.
What is the InChIKey of N-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide?
The InChIKey is JXTRAFQPLNSWPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-3-8-12-9-10(14)13-11(2)6-4-5-7-11/h3,12H,1,4-9H2,2H3,(H,13,14).
What are the key properties of N-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide?
N-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide has a molecular weight of 196.29 g/mol, XLogP of 1.21, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylcyclopentyl)-2-(prop-2-enylamino)acetamide is sourced from PubChem (CID 79279826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).