N-methyl-N-prop-1-en-2-ylcyclobutanecarboximidamide

C9H16N2 — CID 143110793

IUPACN-methyl-N-prop-1-en-2-ylcyclobutanecarboximidamide
SMILES[H]/N=C(\C1CCC1)N(C)C(=C)C
InChIInChI=1S/C9H16N2/c1-7(2)11(3)9(10)8-5-4-6-8/h8,10H,1,4-6H2,2-3H3/b10-9+
InChIKeyZYXIYZVHUBXUTI-MDZDMXLPSA-N
MW152.24 g/mol
LogP2.23
Rot. Bonds2

About N-methyl-N-prop-1-en-2-ylcyclobutanecarboximidamide

N-methyl-N-prop-1-en-2-ylcyclobutanecarboximidamide (PubChem CID 143110793) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is N-methyl-N-prop-1-en-2-ylcyclobutanecarboximidamide.

Molecular Properties

Compound NameN-methyl-N-prop-1-en-2-ylcyclobutanecarboximidamide
PubChem CID143110793
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC NameN-methyl-N-prop-1-en-2-ylcyclobutanecarboximidamide
SMILES[H]/N=C(\C1CCC1)N(C)C(=C)C
InChIInChI=1S/C9H16N2/c1-7(2)11(3)9(10)8-5-4-6-8/h8,10H,1,4-6H2,2-3H3/b10-9+
InChIKeyZYXIYZVHUBXUTI-MDZDMXLPSA-N
XLogP2.23
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.23
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-methyl-N-prop-1-en-2-ylcyclobutanecarboximidamide?
The IUPAC name of N-methyl-N-prop-1-en-2-ylcyclobutanecarboximidamide (CID 143110793) is N-methyl-N-prop-1-en-2-ylcyclobutanecarboximidamide.
What is the SMILES notation for N-methyl-N-prop-1-en-2-ylcyclobutanecarboximidamide?
The canonical SMILES for N-methyl-N-prop-1-en-2-ylcyclobutanecarboximidamide is [H]/N=C(\C1CCC1)N(C)C(=C)C.
What is the InChIKey of N-methyl-N-prop-1-en-2-ylcyclobutanecarboximidamide?
The InChIKey is ZYXIYZVHUBXUTI-MDZDMXLPSA-N. The full InChI is InChI=1S/C9H16N2/c1-7(2)11(3)9(10)8-5-4-6-8/h8,10H,1,4-6H2,2-3H3/b10-9+.
What are the key properties of N-methyl-N-prop-1-en-2-ylcyclobutanecarboximidamide?
N-methyl-N-prop-1-en-2-ylcyclobutanecarboximidamide has a molecular weight of 152.24 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-prop-1-en-2-ylcyclobutanecarboximidamide is sourced from PubChem (CID 143110793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).