(Z)-N'-ethyl-4-methyl-N-methylidenepent-2-enimidamide

C9H16N2 — CID 123530774

IUPAC(Z)-N'-ethyl-4-methyl-N-methylidenepent-2-enimidamide
SMILESC=NC(/C=C\C(C)C)=N\CC
InChIInChI=1S/C9H16N2/c1-5-11-9(10-4)7-6-8(2)3/h6-8H,4-5H2,1-3H3/b7-6-,11-9-
InChIKeyYJMBSQXWDZFDLW-XEZITKEBSA-N
MW152.24 g/mol
LogP2.32
Rot. Bonds3

About (Z)-N'-ethyl-4-methyl-N-methylidenepent-2-enimidamide

(Z)-N'-ethyl-4-methyl-N-methylidenepent-2-enimidamide (PubChem CID 123530774) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is (Z)-N'-ethyl-4-methyl-N-methylidenepent-2-enimidamide.

Molecular Properties

Compound Name(Z)-N'-ethyl-4-methyl-N-methylidenepent-2-enimidamide
PubChem CID123530774
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name(Z)-N'-ethyl-4-methyl-N-methylidenepent-2-enimidamide
SMILESC=NC(/C=C\C(C)C)=N\CC
InChIInChI=1S/C9H16N2/c1-5-11-9(10-4)7-6-8(2)3/h6-8H,4-5H2,1-3H3/b7-6-,11-9-
InChIKeyYJMBSQXWDZFDLW-XEZITKEBSA-N
XLogP2.32
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N-iodo-3-[(E)-prop-1-enyl]-2,3-dihydropyridin-6-amine
CID 89038546
N,N,3-trimethyl-2,3-dihydropyridin-6-amine
CID 118066584
(2Z)-N',4-dimethylhexa-2,5-dienimidamide
CID 123486543
(3E,6Z)-N-propyl-5H-azocin-2-imine
CID 123511104
N'-methyl-N-[(E)-4-methylpent-2-enylidene]methanimidamide
CID 132243203
N'-methyl-N-[(Z)-5-methylhex-2-enylidene]methanimidamide
CID 132243242
N'-[(2E,4Z)-4-ethyl-8-methylnona-2,4,7-trienyl]-N-methylideneethanimidamide
CID 138483254
(2Z,4S,5Z)-4-methyl-N-prop-2-enylhepta-2,5-dien-1-imine
CID 139406469
ethane;(3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine
CID 142845485
2,4,4-Trimethyl-1,3-diazepine
CID 143263086
(2E,6Z,8E)-N'-(2-methylpropyl)deca-2,6,8-trienimidamide
CID 143753026
N'-[(3E,5Z)-hepta-3,5-dienyl]-N-methylideneethanimidamide
CID 144168529

Frequently Asked Questions

What is the IUPAC name of (Z)-N'-ethyl-4-methyl-N-methylidenepent-2-enimidamide?
The IUPAC name of (Z)-N'-ethyl-4-methyl-N-methylidenepent-2-enimidamide (CID 123530774) is (Z)-N'-ethyl-4-methyl-N-methylidenepent-2-enimidamide.
What is the SMILES notation for (Z)-N'-ethyl-4-methyl-N-methylidenepent-2-enimidamide?
The canonical SMILES for (Z)-N'-ethyl-4-methyl-N-methylidenepent-2-enimidamide is C=NC(/C=C\C(C)C)=N\CC.
What is the InChIKey of (Z)-N'-ethyl-4-methyl-N-methylidenepent-2-enimidamide?
The InChIKey is YJMBSQXWDZFDLW-XEZITKEBSA-N. The full InChI is InChI=1S/C9H16N2/c1-5-11-9(10-4)7-6-8(2)3/h6-8H,4-5H2,1-3H3/b7-6-,11-9-.
What are the key properties of (Z)-N'-ethyl-4-methyl-N-methylidenepent-2-enimidamide?
(Z)-N'-ethyl-4-methyl-N-methylidenepent-2-enimidamide has a molecular weight of 152.24 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N'-ethyl-4-methyl-N-methylidenepent-2-enimidamide is sourced from PubChem (CID 123530774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).