N'-methyl-N-propan-2-ylidenemethanimidamide

C5H10N2 — CID 21338724

IUPACN'-methyl-N-propan-2-ylidenemethanimidamide
SMILESC/N=C/N=C(C)C
InChIInChI=1S/C5H10N2/c1-5(2)7-4-6-3/h4H,1-3H3/b6-4+
InChIKeyVKLVSLNOXDMMKZ-GQCTYLIASA-N
MW98.15 g/mol
LogP1.13
Rot. Bonds1

About N'-methyl-N-propan-2-ylidenemethanimidamide

N'-methyl-N-propan-2-ylidenemethanimidamide (PubChem CID 21338724) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol. Its IUPAC name is N'-methyl-N-propan-2-ylidenemethanimidamide.

Molecular Properties

Compound NameN'-methyl-N-propan-2-ylidenemethanimidamide
PubChem CID21338724
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC NameN'-methyl-N-propan-2-ylidenemethanimidamide
SMILESC/N=C/N=C(C)C
InChIInChI=1S/C5H10N2/c1-5(2)7-4-6-3/h4H,1-3H3/b6-4+
InChIKeyVKLVSLNOXDMMKZ-GQCTYLIASA-N
XLogP1.13
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.15
LogP ≤ 51.13
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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Frequently Asked Questions

What is the IUPAC name of N'-methyl-N-propan-2-ylidenemethanimidamide?
The IUPAC name of N'-methyl-N-propan-2-ylidenemethanimidamide (CID 21338724) is N'-methyl-N-propan-2-ylidenemethanimidamide.
What is the SMILES notation for N'-methyl-N-propan-2-ylidenemethanimidamide?
The canonical SMILES for N'-methyl-N-propan-2-ylidenemethanimidamide is C/N=C/N=C(C)C.
What is the InChIKey of N'-methyl-N-propan-2-ylidenemethanimidamide?
The InChIKey is VKLVSLNOXDMMKZ-GQCTYLIASA-N. The full InChI is InChI=1S/C5H10N2/c1-5(2)7-4-6-3/h4H,1-3H3/b6-4+.
What are the key properties of N'-methyl-N-propan-2-ylidenemethanimidamide?
N'-methyl-N-propan-2-ylidenemethanimidamide has a molecular weight of 98.15 g/mol, XLogP of 1.13, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N-propan-2-ylidenemethanimidamide is sourced from PubChem (CID 21338724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).