cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone

C10H18N2O — CID 60817866

IUPACcyclopropyl-[4-(methylamino)piperidin-1-yl]methanone
SMILESCNC1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C10H18N2O/c1-11-9-4-6-12(7-5-9)10(13)8-2-3-8/h8-9,11H,2-7H2,1H3
InChIKeyVDMRFUNONTXBEY-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.61
Rot. Bonds2

About cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone

cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone (PubChem CID 60817866) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[4-(methylamino)piperidin-1-yl]methanone
PubChem CID60817866
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Namecyclopropyl-[4-(methylamino)piperidin-1-yl]methanone
SMILESCNC1CCN(C(=O)C2CC2)CC1
InChIInChI=1S/C10H18N2O/c1-11-9-4-6-12(7-5-9)10(13)8-2-3-8/h8-9,11H,2-7H2,1H3
InChIKeyVDMRFUNONTXBEY-UHFFFAOYSA-N
XLogP0.61
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone?
The IUPAC name of cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone (CID 60817866) is cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone?
The canonical SMILES for cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone is CNC1CCN(C(=O)C2CC2)CC1.
What is the InChIKey of cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone?
The InChIKey is VDMRFUNONTXBEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-11-9-4-6-12(7-5-9)10(13)8-2-3-8/h8-9,11H,2-7H2,1H3.
What are the key properties of cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone?
cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone has a molecular weight of 182.27 g/mol, XLogP of 0.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone is sourced from PubChem (CID 60817866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).