N-(1-methylcyclopropyl)cyclopropanecarboxamide

C8H13NO — CID 115634337

IUPACN-(1-methylcyclopropyl)cyclopropanecarboxamide
SMILESCC1(NC(=O)C2CC2)CC1
InChIInChI=1S/C8H13NO/c1-8(4-5-8)9-7(10)6-2-3-6/h6H,2-5H2,1H3,(H,9,10)
InChIKeyVDWIENHWGYFJQB-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.07
Rot. Bonds2

About N-(1-methylcyclopropyl)cyclopropanecarboxamide

N-(1-methylcyclopropyl)cyclopropanecarboxamide (PubChem CID 115634337) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is N-(1-methylcyclopropyl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(1-methylcyclopropyl)cyclopropanecarboxamide
PubChem CID115634337
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC NameN-(1-methylcyclopropyl)cyclopropanecarboxamide
SMILESCC1(NC(=O)C2CC2)CC1
InChIInChI=1S/C8H13NO/c1-8(4-5-8)9-7(10)6-2-3-6/h6H,2-5H2,1H3,(H,9,10)
InChIKeyVDWIENHWGYFJQB-UHFFFAOYSA-N
XLogP1.07
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(1-methylcyclopropyl)cyclopropanecarboxamide?
The IUPAC name of N-(1-methylcyclopropyl)cyclopropanecarboxamide (CID 115634337) is N-(1-methylcyclopropyl)cyclopropanecarboxamide.
What is the SMILES notation for N-(1-methylcyclopropyl)cyclopropanecarboxamide?
The canonical SMILES for N-(1-methylcyclopropyl)cyclopropanecarboxamide is CC1(NC(=O)C2CC2)CC1.
What is the InChIKey of N-(1-methylcyclopropyl)cyclopropanecarboxamide?
The InChIKey is VDWIENHWGYFJQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c1-8(4-5-8)9-7(10)6-2-3-6/h6H,2-5H2,1H3,(H,9,10).
What are the key properties of N-(1-methylcyclopropyl)cyclopropanecarboxamide?
N-(1-methylcyclopropyl)cyclopropanecarboxamide has a molecular weight of 139.20 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylcyclopropyl)cyclopropanecarboxamide is sourced from PubChem (CID 115634337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).