(E)-2-propylpent-2-enimidamide

C8H16N2 — CID 123835678

IUPAC(E)-2-propylpent-2-enimidamide
SMILES[H]/N=C(N)/C(=C/CC)CCC
InChIInChI=1S/C8H16N2/c1-3-5-7(6-4-2)8(9)10/h5H,3-4,6H2,1-2H3,(H3,9,10)/b7-5+
InChIKeyPYVMXESLSMHIDI-FNORWQNLSA-N
MW140.23 g/mol
LogP2.06
Rot. Bonds4

About (E)-2-propylpent-2-enimidamide

(E)-2-propylpent-2-enimidamide (PubChem CID 123835678) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (E)-2-propylpent-2-enimidamide.

Molecular Properties

Compound Name(E)-2-propylpent-2-enimidamide
PubChem CID123835678
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(E)-2-propylpent-2-enimidamide
SMILES[H]/N=C(N)/C(=C/CC)CCC
InChIInChI=1S/C8H16N2/c1-3-5-7(6-4-2)8(9)10/h5H,3-4,6H2,1-2H3,(H3,9,10)/b7-5+
InChIKeyPYVMXESLSMHIDI-FNORWQNLSA-N
XLogP2.06
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 52.06
H-Bond Donors ≤ 52
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

Cyclohexene-1-carboximidamide
CID 68077891
(Z)-2-propan-2-ylhex-2-enimidamide
CID 88782432
(Z)-4-methyl-2-propan-2-ylpent-2-enimidamide
CID 88783504
4-Methylcyclohexa-1,3-diene-1-carboximidamide
CID 89378274
(4E)-2,5-dimethylhepta-2,4-dienimidamide
CID 123195726
(2E,3Z)-2-ethylidene-3,5-dimethylhexa-3,5-dienimidamide
CID 123772432
(2E)-2-ethylidene-3-imino-5-methylhex-4-enimidamide
CID 123990994
(3E)-6-methyl-2-methylidene-3-prop-1-en-2-ylhepta-3,5-dienimidamide
CID 129299695
(2E,4E)-2,5-dimethylhepta-2,4-dienimidamide
CID 134409274
(E)-2-propylpent-2-en-4-ynimidamide
CID 137386621
4-Methyl-2-propylpent-2-enimidamide
CID 140325497
(3E)-4,8-dimethylnona-3,7-dienimidamide
CID 141825805

Frequently Asked Questions

What is the IUPAC name of (E)-2-propylpent-2-enimidamide?
The IUPAC name of (E)-2-propylpent-2-enimidamide (CID 123835678) is (E)-2-propylpent-2-enimidamide.
What is the SMILES notation for (E)-2-propylpent-2-enimidamide?
The canonical SMILES for (E)-2-propylpent-2-enimidamide is [H]/N=C(N)/C(=C/CC)CCC.
What is the InChIKey of (E)-2-propylpent-2-enimidamide?
The InChIKey is PYVMXESLSMHIDI-FNORWQNLSA-N. The full InChI is InChI=1S/C8H16N2/c1-3-5-7(6-4-2)8(9)10/h5H,3-4,6H2,1-2H3,(H3,9,10)/b7-5+.
What are the key properties of (E)-2-propylpent-2-enimidamide?
(E)-2-propylpent-2-enimidamide has a molecular weight of 140.23 g/mol, XLogP of 2.06, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-propylpent-2-enimidamide is sourced from PubChem (CID 123835678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).