N',2-dimethyl-N-[(Z)-4-methylpent-2-en-3-yl]propanimidamide

C11H22N2 — CID 174256134

IUPACN',2-dimethyl-N-[(Z)-4-methylpent-2-en-3-yl]propanimidamide
SMILESC/C=C(\N/C(=N/C)C(C)C)C(C)C
InChIInChI=1S/C11H22N2/c1-7-10(8(2)3)13-11(12-6)9(4)5/h7-9H,1-6H3,(H,12,13)/b10-7-
InChIKeyUHLHUTFVJABGDC-YFHOEESVSA-N
MW182.31 g/mol
LogP2.82
Rot. Bonds3

About N',2-dimethyl-N-[(Z)-4-methylpent-2-en-3-yl]propanimidamide

N',2-dimethyl-N-[(Z)-4-methylpent-2-en-3-yl]propanimidamide (PubChem CID 174256134) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is N',2-dimethyl-N-[(Z)-4-methylpent-2-en-3-yl]propanimidamide.

Molecular Properties

Compound NameN',2-dimethyl-N-[(Z)-4-methylpent-2-en-3-yl]propanimidamide
PubChem CID174256134
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC NameN',2-dimethyl-N-[(Z)-4-methylpent-2-en-3-yl]propanimidamide
SMILESC/C=C(\N/C(=N/C)C(C)C)C(C)C
InChIInChI=1S/C11H22N2/c1-7-10(8(2)3)13-11(12-6)9(4)5/h7-9H,1-6H3,(H,12,13)/b10-7-
InChIKeyUHLHUTFVJABGDC-YFHOEESVSA-N
XLogP2.82
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 52.82
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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Frequently Asked Questions

What is the IUPAC name of N',2-dimethyl-N-[(Z)-4-methylpent-2-en-3-yl]propanimidamide?
The IUPAC name of N',2-dimethyl-N-[(Z)-4-methylpent-2-en-3-yl]propanimidamide (CID 174256134) is N',2-dimethyl-N-[(Z)-4-methylpent-2-en-3-yl]propanimidamide.
What is the SMILES notation for N',2-dimethyl-N-[(Z)-4-methylpent-2-en-3-yl]propanimidamide?
The canonical SMILES for N',2-dimethyl-N-[(Z)-4-methylpent-2-en-3-yl]propanimidamide is C/C=C(\N/C(=N/C)C(C)C)C(C)C.
What is the InChIKey of N',2-dimethyl-N-[(Z)-4-methylpent-2-en-3-yl]propanimidamide?
The InChIKey is UHLHUTFVJABGDC-YFHOEESVSA-N. The full InChI is InChI=1S/C11H22N2/c1-7-10(8(2)3)13-11(12-6)9(4)5/h7-9H,1-6H3,(H,12,13)/b10-7-.
What are the key properties of N',2-dimethyl-N-[(Z)-4-methylpent-2-en-3-yl]propanimidamide?
N',2-dimethyl-N-[(Z)-4-methylpent-2-en-3-yl]propanimidamide has a molecular weight of 182.31 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N',2-dimethyl-N-[(Z)-4-methylpent-2-en-3-yl]propanimidamide is sourced from PubChem (CID 174256134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).