(E)-N-cyclopentyl-2-methylbut-2-enamide

C10H17NO — CID 89351716

IUPAC(E)-N-cyclopentyl-2-methylbut-2-enamide
SMILESC/C=C(\C)C(=O)NC1CCCC1
InChIInChI=1S/C10H17NO/c1-3-8(2)10(12)11-9-6-4-5-7-9/h3,9H,4-7H2,1-2H3,(H,11,12)/b8-3+
InChIKeyPCBQQWWBVBWUKG-FPYGCLRLSA-N
MW167.25 g/mol
LogP2.01
Rot. Bonds2

About (E)-N-cyclopentyl-2-methylbut-2-enamide

(E)-N-cyclopentyl-2-methylbut-2-enamide (PubChem CID 89351716) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is (E)-N-cyclopentyl-2-methylbut-2-enamide.

Molecular Properties

Compound Name(E)-N-cyclopentyl-2-methylbut-2-enamide
PubChem CID89351716
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name(E)-N-cyclopentyl-2-methylbut-2-enamide
SMILESC/C=C(\C)C(=O)NC1CCCC1
InChIInChI=1S/C10H17NO/c1-3-8(2)10(12)11-9-6-4-5-7-9/h3,9H,4-7H2,1-2H3,(H,11,12)/b8-3+
InChIKeyPCBQQWWBVBWUKG-FPYGCLRLSA-N
XLogP2.01
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

(E)-N-cyclohexyl-2-methylbut-2-enamide
CID 14316395
N-cyclohexyl-2-oxopropanamide
CID 12861109
2-[[(Z)-2-methylbut-2-enoyl]amino]cyclohexane-1-carboxylic acid
CID 115909861
N-cyclododecyl-2-methylprop-2-enamide
CID 66733963
(E)-N-cyclohexyl-3-methyl-4-oxopent-2-enamide
CID 10878394
(Z)-N-cyclopentyl-3-(methylamino)-2-sulfanylprop-2-enamide
CID 88958739
N-cyclohexyl-2-methylprop-2-enamide;2-methylprop-2-enoic acid
CID 175055430
(E)-N-cyclohexyl-3-(2-fluorophenyl)-2-methylprop-2-enamide
CID 110298620
N-cycloheptyl-2-(cyclopentylamino)-2-sulfanylideneacetamide
CID 2975425
N-cycloheptyl-3-methylbut-2-enamide
CID 51109528
2-(4-acetylpiperazin-1-yl)-N-cyclododecyl-2-oxoacetamide
CID 108508318
N-cyclohexyl-4-ethoxy-2-ethylidenepent-3-enamide
CID 123169280

Frequently Asked Questions

What is the IUPAC name of (E)-N-cyclopentyl-2-methylbut-2-enamide?
The IUPAC name of (E)-N-cyclopentyl-2-methylbut-2-enamide (CID 89351716) is (E)-N-cyclopentyl-2-methylbut-2-enamide.
What is the SMILES notation for (E)-N-cyclopentyl-2-methylbut-2-enamide?
The canonical SMILES for (E)-N-cyclopentyl-2-methylbut-2-enamide is C/C=C(\C)C(=O)NC1CCCC1.
What is the InChIKey of (E)-N-cyclopentyl-2-methylbut-2-enamide?
The InChIKey is PCBQQWWBVBWUKG-FPYGCLRLSA-N. The full InChI is InChI=1S/C10H17NO/c1-3-8(2)10(12)11-9-6-4-5-7-9/h3,9H,4-7H2,1-2H3,(H,11,12)/b8-3+.
What are the key properties of (E)-N-cyclopentyl-2-methylbut-2-enamide?
(E)-N-cyclopentyl-2-methylbut-2-enamide has a molecular weight of 167.25 g/mol, XLogP of 2.01, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-cyclopentyl-2-methylbut-2-enamide is sourced from PubChem (CID 89351716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).