(Z)-3-cyclohexylbut-2-enamide

C10H17NO — CID 19353012

IUPAC(Z)-3-cyclohexylbut-2-enamide
SMILESC/C(=C/C(N)=O)C1CCCCC1
InChIInChI=1S/C10H17NO/c1-8(7-10(11)12)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3,(H2,11,12)/b8-7-
InChIKeyDNOOPRPEKICBDD-FPLPWBNLSA-N
MW167.25 g/mol
LogP2.00
Rot. Bonds2

About (Z)-3-cyclohexylbut-2-enamide

(Z)-3-cyclohexylbut-2-enamide (PubChem CID 19353012) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is (Z)-3-cyclohexylbut-2-enamide.

Molecular Properties

Compound Name(Z)-3-cyclohexylbut-2-enamide
PubChem CID19353012
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name(Z)-3-cyclohexylbut-2-enamide
SMILESC/C(=C/C(N)=O)C1CCCCC1
InChIInChI=1S/C10H17NO/c1-8(7-10(11)12)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3,(H2,11,12)/b8-7-
InChIKeyDNOOPRPEKICBDD-FPLPWBNLSA-N
XLogP2.00
TPSA43.09 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 ≤ 52.00
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

(Z)-3-cyclopropylbut-2-enamide
CID 55218842
(E)-3-cyclohexylbut-2-enoic acid
CID 6537440
2-cyclohexylbut-2-enediamide
CID 151583610
ethyl (E)-3-cyclopentylbut-2-enoate
CID 89095864
ethyl (E)-3-cyclobutylbut-2-enoate
CID 89095848
methyl (E)-3-cyclobutylbut-2-enoate
CID 89095849
[(E)-1-bromoprop-1-en-2-yl]cyclohexane
CID 87467219
3-cyclohexyl-2-methylbut-2-enamide
CID 70347736
(E)-4-cyclohexyl-N-ethylpent-3-en-2-imine
CID 142125943
[(E)-3-cyclohexylbut-2-enyl] methyl carbonate
CID 11031157
4-cyclohexylpent-3-en-1-amine
CID 76996947
acetaldehyde;1-cyclohexylethanone;ethane
CID 145408304

Frequently Asked Questions

What is the IUPAC name of (Z)-3-cyclohexylbut-2-enamide?
The IUPAC name of (Z)-3-cyclohexylbut-2-enamide (CID 19353012) is (Z)-3-cyclohexylbut-2-enamide.
What is the SMILES notation for (Z)-3-cyclohexylbut-2-enamide?
The canonical SMILES for (Z)-3-cyclohexylbut-2-enamide is C/C(=C/C(N)=O)C1CCCCC1.
What is the InChIKey of (Z)-3-cyclohexylbut-2-enamide?
The InChIKey is DNOOPRPEKICBDD-FPLPWBNLSA-N. The full InChI is InChI=1S/C10H17NO/c1-8(7-10(11)12)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3,(H2,11,12)/b8-7-.
What are the key properties of (Z)-3-cyclohexylbut-2-enamide?
(Z)-3-cyclohexylbut-2-enamide has a molecular weight of 167.25 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-cyclohexylbut-2-enamide is sourced from PubChem (CID 19353012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).