N-(1-methylcyclopentyl)pent-4-ynamide

C11H17NO — CID 130688553

IUPACN-(1-methylcyclopentyl)pent-4-ynamide
SMILESC#CCCC(=O)NC1(C)CCCC1
InChIInChI=1S/C11H17NO/c1-3-4-7-10(13)12-11(2)8-5-6-9-11/h1H,4-9H2,2H3,(H,12,13)
InChIKeyXECARRCLHQQENG-UHFFFAOYSA-N
MW179.26 g/mol
LogP1.85
Rot. Bonds3

About N-(1-methylcyclopentyl)pent-4-ynamide

N-(1-methylcyclopentyl)pent-4-ynamide (PubChem CID 130688553) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is N-(1-methylcyclopentyl)pent-4-ynamide.

Molecular Properties

Compound NameN-(1-methylcyclopentyl)pent-4-ynamide
PubChem CID130688553
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC NameN-(1-methylcyclopentyl)pent-4-ynamide
SMILESC#CCCC(=O)NC1(C)CCCC1
InChIInChI=1S/C11H17NO/c1-3-4-7-10(13)12-11(2)8-5-6-9-11/h1H,4-9H2,2H3,(H,12,13)
InChIKeyXECARRCLHQQENG-UHFFFAOYSA-N
XLogP1.85
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(1-methylcyclohexyl)-3-sulfanylpropanamide
CID 107027315
N-(1-methylcyclopentyl)-2-methylsulfanylacetamide
CID 131154660
N-[(1-hydroxycyclobutyl)methyl]pent-4-ynamide
CID 106741500
N-(1-methylcyclobutyl)propanamide
CID 115766065
N-(1-methylcyclohexyl)-3-piperidin-4-ylpropanamide
CID 62211330
2-(1-aminocyclopentyl)-N-(1-methylcyclopentyl)acetamide
CID 64677004
methanamine;N-methylpent-4-ynamide
CID 160899629
N-(3-hydroxy-2-methylpropyl)pent-4-ynamide
CID 106741596
3-amino-3-hydroxyimino-N-(1-methylcyclopentyl)propanamide
CID 77051955
N-(1-methylcyclopropyl)-4-sulfanylbutanamide
CID 130595662
1-(1-methylcyclopropyl)-3-pent-4-yn-2-ylurea
CID 131207081
3,3-dimethyl-5-[(1-methylcyclopentyl)amino]-5-oxopentanoic acid
CID 62934594

Frequently Asked Questions

What is the IUPAC name of N-(1-methylcyclopentyl)pent-4-ynamide?
The IUPAC name of N-(1-methylcyclopentyl)pent-4-ynamide (CID 130688553) is N-(1-methylcyclopentyl)pent-4-ynamide.
What is the SMILES notation for N-(1-methylcyclopentyl)pent-4-ynamide?
The canonical SMILES for N-(1-methylcyclopentyl)pent-4-ynamide is C#CCCC(=O)NC1(C)CCCC1.
What is the InChIKey of N-(1-methylcyclopentyl)pent-4-ynamide?
The InChIKey is XECARRCLHQQENG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-3-4-7-10(13)12-11(2)8-5-6-9-11/h1H,4-9H2,2H3,(H,12,13).
What are the key properties of N-(1-methylcyclopentyl)pent-4-ynamide?
N-(1-methylcyclopentyl)pent-4-ynamide has a molecular weight of 179.26 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylcyclopentyl)pent-4-ynamide is sourced from PubChem (CID 130688553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).