(1-methylcyclopropyl)-pyrrolidin-1-ylmethanone

C9H15NO — CID 118460816

IUPAC(1-methylcyclopropyl)-pyrrolidin-1-ylmethanone
SMILESCC1(C(=O)N2CCCC2)CC1
InChIInChI=1S/C9H15NO/c1-9(4-5-9)8(11)10-6-2-3-7-10/h2-7H2,1H3
InChIKeyZCBXALPOWQKCOV-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.41
Rot. Bonds1

About (1-methylcyclopropyl)-pyrrolidin-1-ylmethanone

(1-methylcyclopropyl)-pyrrolidin-1-ylmethanone (PubChem CID 118460816) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is (1-methylcyclopropyl)-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name(1-methylcyclopropyl)-pyrrolidin-1-ylmethanone
PubChem CID118460816
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name(1-methylcyclopropyl)-pyrrolidin-1-ylmethanone
SMILESCC1(C(=O)N2CCCC2)CC1
InChIInChI=1S/C9H15NO/c1-9(4-5-9)8(11)10-6-2-3-7-10/h2-7H2,1H3
InChIKeyZCBXALPOWQKCOV-UHFFFAOYSA-N
XLogP1.41
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1-methylcyclopropyl)-pyrrolidin-1-ylmethanone?
The IUPAC name of (1-methylcyclopropyl)-pyrrolidin-1-ylmethanone (CID 118460816) is (1-methylcyclopropyl)-pyrrolidin-1-ylmethanone.
What is the SMILES notation for (1-methylcyclopropyl)-pyrrolidin-1-ylmethanone?
The canonical SMILES for (1-methylcyclopropyl)-pyrrolidin-1-ylmethanone is CC1(C(=O)N2CCCC2)CC1.
What is the InChIKey of (1-methylcyclopropyl)-pyrrolidin-1-ylmethanone?
The InChIKey is ZCBXALPOWQKCOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-9(4-5-9)8(11)10-6-2-3-7-10/h2-7H2,1H3.
What are the key properties of (1-methylcyclopropyl)-pyrrolidin-1-ylmethanone?
(1-methylcyclopropyl)-pyrrolidin-1-ylmethanone has a molecular weight of 153.22 g/mol, XLogP of 1.41, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylcyclopropyl)-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 118460816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).