(Z)-N'-decylbut-2-enediamide

C14H26N2O2 — CID 87339219

IUPAC(Z)-N'-decylbut-2-enediamide
SMILESCCCCCCCCCCNC(=O)/C=C\C(N)=O
InChIInChI=1S/C14H26N2O2/c1-2-3-4-5-6-7-8-9-12-16-14(18)11-10-13(15)17/h10-11H,2-9,12H2,1H3,(H2,15,17)(H,16,18)/b11-10-
InChIKeyNRYGCICLBPJWHA-KHPPLWFESA-N
MW254.37 g/mol
LogP2.28
Rot. Bonds11

About (Z)-N'-decylbut-2-enediamide

(Z)-N'-decylbut-2-enediamide (PubChem CID 87339219) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is (Z)-N'-decylbut-2-enediamide.

Molecular Properties

Compound Name(Z)-N'-decylbut-2-enediamide
PubChem CID87339219
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name(Z)-N'-decylbut-2-enediamide
SMILESCCCCCCCCCCNC(=O)/C=C\C(N)=O
InChIInChI=1S/C14H26N2O2/c1-2-3-4-5-6-7-8-9-12-16-14(18)11-10-13(15)17/h10-11H,2-9,12H2,1H3,(H2,15,17)(H,16,18)/b11-10-
InChIKeyNRYGCICLBPJWHA-KHPPLWFESA-N
XLogP2.28
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-hexylbut-2-enediamide
CID 154301502
(2E,4E)-N,N'-di(tetradecyl)hexa-2,4-dienediamide
CID 101160253
(2Z,4Z)-N,N'-di(tetradecyl)hexa-2,4-dienediamide
CID 102438927
(Z)-4-(hexylamino)-4-oxobut-2-enoic acid;lanthanum
CID 174988746
ethyl (Z)-4-(dodecylamino)-4-oxobut-2-enoate
CID 139670344
methyl (Z)-4-(hexylamino)-4-oxobut-2-enoate
CID 6442503
butyl (Z)-4-(dodecylamino)-4-oxobut-2-enoate
CID 139670311
N-hexyl-4-iminopent-2-enamide
CID 123662070
(Z)-4-[[(Z)-docos-13-enyl]amino]-4-oxobut-2-enoic acid
CID 86748487
N-heptadecylprop-2-enamide
CID 20727742
(E)-N-butyldec-2-enamide
CID 160628271
1-aminododecyl (Z)-4-(dodecylamino)-4-oxobut-2-enoate
CID 87987439

Frequently Asked Questions

What is the IUPAC name of (Z)-N'-decylbut-2-enediamide?
The IUPAC name of (Z)-N'-decylbut-2-enediamide (CID 87339219) is (Z)-N'-decylbut-2-enediamide.
What is the SMILES notation for (Z)-N'-decylbut-2-enediamide?
The canonical SMILES for (Z)-N'-decylbut-2-enediamide is CCCCCCCCCCNC(=O)/C=C\C(N)=O.
What is the InChIKey of (Z)-N'-decylbut-2-enediamide?
The InChIKey is NRYGCICLBPJWHA-KHPPLWFESA-N. The full InChI is InChI=1S/C14H26N2O2/c1-2-3-4-5-6-7-8-9-12-16-14(18)11-10-13(15)17/h10-11H,2-9,12H2,1H3,(H2,15,17)(H,16,18)/b11-10-.
What are the key properties of (Z)-N'-decylbut-2-enediamide?
(Z)-N'-decylbut-2-enediamide has a molecular weight of 254.37 g/mol, XLogP of 2.28, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N'-decylbut-2-enediamide is sourced from PubChem (CID 87339219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).