N'-ethyl-N-pent-3-en-2-ylmethanimidamide

C8H16N2 — CID 123174710

IUPACN'-ethyl-N-pent-3-en-2-ylmethanimidamide
SMILESCC=CC(C)N/C=N/CC
InChIInChI=1S/C8H16N2/c1-4-6-8(3)10-7-9-5-2/h4,6-8H,5H2,1-3H3,(H,9,10)
InChIKeyHKAFWDQMMXNARM-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.59
Rot. Bonds4

About N'-ethyl-N-pent-3-en-2-ylmethanimidamide

N'-ethyl-N-pent-3-en-2-ylmethanimidamide (PubChem CID 123174710) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is N'-ethyl-N-pent-3-en-2-ylmethanimidamide.

Molecular Properties

Compound NameN'-ethyl-N-pent-3-en-2-ylmethanimidamide
PubChem CID123174710
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC NameN'-ethyl-N-pent-3-en-2-ylmethanimidamide
SMILESCC=CC(C)N/C=N/CC
InChIInChI=1S/C8H16N2/c1-4-6-8(3)10-7-9-5-2/h4,6-8H,5H2,1-3H3,(H,9,10)
InChIKeyHKAFWDQMMXNARM-UHFFFAOYSA-N
XLogP1.59
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.59
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N'-[(E)-4-fluorobut-3-en-2-yl]-N-[(Z)-pent-3-en-2-yl]ethanimidamide
CID 144414903
4,6-Dimethyl-1,4-dihydropyrimidine
CID 68223411
N-[(E)-pent-3-en-2-yl]-N'-propylmethanimidamide
CID 121451366
N'-methyl-N-pent-3-enylmethanimidamide
CID 123321967
N'-(1-amino-6-ethyl-2-methylnona-2,5,8-trienyl)-N-pentan-2-ylmethanimidamide
CID 123384239
N'-ethyl-N-[(Z)-pent-2-en-2-yl]methanimidamide
CID 123627993
N'-[(Z)-but-2-enyl]-N-but-3-en-2-ylmethanimidamide
CID 134350120
N'-buta-1,3-dien-2-yl-N-[(3Z)-hexa-1,3-dien-2-yl]methanimidamide
CID 135208586
N'-butan-2-yl-N-[(3E)-hexa-3,5-dien-3-yl]methanimidamide
CID 135243193
N-ethyl-5-(methylideneamino)pent-3-en-2-amine
CID 138511218
N'-ethyl-N-[(3Z)-hexa-1,3-dien-2-yl]methanimidamide
CID 138528224
N'-but-3-en-2-yl-N-[(3Z)-hexa-1,3,5-trien-2-yl]methanimidamide
CID 139435496

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N-pent-3-en-2-ylmethanimidamide?
The IUPAC name of N'-ethyl-N-pent-3-en-2-ylmethanimidamide (CID 123174710) is N'-ethyl-N-pent-3-en-2-ylmethanimidamide.
What is the SMILES notation for N'-ethyl-N-pent-3-en-2-ylmethanimidamide?
The canonical SMILES for N'-ethyl-N-pent-3-en-2-ylmethanimidamide is CC=CC(C)N/C=N/CC.
What is the InChIKey of N'-ethyl-N-pent-3-en-2-ylmethanimidamide?
The InChIKey is HKAFWDQMMXNARM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-4-6-8(3)10-7-9-5-2/h4,6-8H,5H2,1-3H3,(H,9,10).
What are the key properties of N'-ethyl-N-pent-3-en-2-ylmethanimidamide?
N'-ethyl-N-pent-3-en-2-ylmethanimidamide has a molecular weight of 140.23 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N-pent-3-en-2-ylmethanimidamide is sourced from PubChem (CID 123174710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).