N-hex-1-en-2-yl-N',3-dimethylbut-2-enimidamide

C12H22N2 — CID 143316348

IUPACN-hex-1-en-2-yl-N',3-dimethylbut-2-enimidamide
SMILESC=C(CCCC)N/C(C=C(C)C)=N/C
InChIInChI=1S/C12H22N2/c1-6-7-8-11(4)14-12(13-5)9-10(2)3/h9H,4,6-8H2,1-3,5H3,(H,13,14)
InChIKeyYBDVFXJBPRRYEI-UHFFFAOYSA-N
MW194.32 g/mol
LogP3.27
Rot. Bonds5

About N-hex-1-en-2-yl-N',3-dimethylbut-2-enimidamide

N-hex-1-en-2-yl-N',3-dimethylbut-2-enimidamide (PubChem CID 143316348) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is N-hex-1-en-2-yl-N',3-dimethylbut-2-enimidamide.

Molecular Properties

Compound NameN-hex-1-en-2-yl-N',3-dimethylbut-2-enimidamide
PubChem CID143316348
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC NameN-hex-1-en-2-yl-N',3-dimethylbut-2-enimidamide
SMILESC=C(CCCC)N/C(C=C(C)C)=N/C
InChIInChI=1S/C12H22N2/c1-6-7-8-11(4)14-12(13-5)9-10(2)3/h9H,4,6-8H2,1-3,5H3,(H,13,14)
InChIKeyYBDVFXJBPRRYEI-UHFFFAOYSA-N
XLogP3.27
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 53.27
H-Bond Donors ≤ 51
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'-methyl-N-(3-methylhex-1-en-2-yl)ethanimidamide
CID 132095778
N-[(Z)-1-(cyclopenten-1-yl)prop-1-enyl]-N'-methylethanimidamide
CID 134424189
5-methylidene-N-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-amine
CID 142943192
3-methyl-N-(4-methylpent-1-en-2-yl)-2H-pyrrol-5-amine
CID 143316542
ethane;3-(3,4,6,9-tetrahydro-2H-pyrido[2,3-b]azepin-8-yl)propan-1-amine
CID 143997703
5-methyl-N-pent-1-en-2-yl-2,3-dihydropyridin-6-amine
CID 146416395
N-but-1-en-2-yl-4-methyl-2,3-dihydropyridin-6-amine
CID 146416732
5-but-3-enyl-2,4-dimethyl-6-methylidene-1H-pyrimidine
CID 155243022
(Z)-N-but-1-en-2-yl-N'-[(4-ethylcyclopenta-1,3-dien-1-yl)methyl]but-2-enimidamide
CID 156480061
N'-methyl-N-[(6E)-6-methylnona-1,6-dien-2-yl]ethanimidamide
CID 156544655
(7E)-N-but-1-en-2-yl-7-ethylidene-3,4,5,6-tetrahydro-2H-azocin-8-amine
CID 164103271
ethane;5-methylidene-N-prop-1-en-2-yl-3,4-dihydro-2H-pyridin-6-amine
CID 165133724

Frequently Asked Questions

What is the IUPAC name of N-hex-1-en-2-yl-N',3-dimethylbut-2-enimidamide?
The IUPAC name of N-hex-1-en-2-yl-N',3-dimethylbut-2-enimidamide (CID 143316348) is N-hex-1-en-2-yl-N',3-dimethylbut-2-enimidamide.
What is the SMILES notation for N-hex-1-en-2-yl-N',3-dimethylbut-2-enimidamide?
The canonical SMILES for N-hex-1-en-2-yl-N',3-dimethylbut-2-enimidamide is C=C(CCCC)N/C(C=C(C)C)=N/C.
What is the InChIKey of N-hex-1-en-2-yl-N',3-dimethylbut-2-enimidamide?
The InChIKey is YBDVFXJBPRRYEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2/c1-6-7-8-11(4)14-12(13-5)9-10(2)3/h9H,4,6-8H2,1-3,5H3,(H,13,14).
What are the key properties of N-hex-1-en-2-yl-N',3-dimethylbut-2-enimidamide?
N-hex-1-en-2-yl-N',3-dimethylbut-2-enimidamide has a molecular weight of 194.32 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-hex-1-en-2-yl-N',3-dimethylbut-2-enimidamide is sourced from PubChem (CID 143316348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).