(2-methylpiperazin-1-yl)-(2-phenylcyclopropyl)methanone

C15H20N2O — CID 81478367

IUPAC(2-methylpiperazin-1-yl)-(2-phenylcyclopropyl)methanone
SMILESCC1CNCCN1C(=O)C1CC1c1ccccc1
InChIInChI=1S/C15H20N2O/c1-11-10-16-7-8-17(11)15(18)14-9-13(14)12-5-3-2-4-6-12/h2-6,11,13-14,16H,7-10H2,1H3
InChIKeyGASDLZXYRIJQJP-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.61
Rot. Bonds2

About (2-methylpiperazin-1-yl)-(2-phenylcyclopropyl)methanone

(2-methylpiperazin-1-yl)-(2-phenylcyclopropyl)methanone (PubChem CID 81478367) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is (2-methylpiperazin-1-yl)-(2-phenylcyclopropyl)methanone.

Molecular Properties

Compound Name(2-methylpiperazin-1-yl)-(2-phenylcyclopropyl)methanone
PubChem CID81478367
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name(2-methylpiperazin-1-yl)-(2-phenylcyclopropyl)methanone
SMILESCC1CNCCN1C(=O)C1CC1c1ccccc1
InChIInChI=1S/C15H20N2O/c1-11-10-16-7-8-17(11)15(18)14-9-13(14)12-5-3-2-4-6-12/h2-6,11,13-14,16H,7-10H2,1H3
InChIKeyGASDLZXYRIJQJP-UHFFFAOYSA-N
XLogP1.61
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(1S,2S)-2-[(2R)-2-methylpiperazine-1-carbonyl]cyclopropyl]benzamide
CID 59454528
3-[2-[(2R)-2-methylpiperazine-1-carbonyl]cyclopropyl]benzamide
CID 67541062
[(2R)-2-methylpiperazin-1-yl]-[(1R,2R)-2-[2-(trifluoromethyl)phenyl]cyclopropyl]methanone
CID 124571143
[(1S,2S)-2-phenylcyclopropyl]-piperazin-1-ylmethanone
CID 51893718
[(1R,2R)-2-methylcyclopropyl]-(2-methylpiperazin-1-yl)methanone
CID 155385369
(2-methylpiperazin-1-yl)-(4-phenylphenyl)methanone
CID 69401759
[2-(4-fluorophenyl)cyclopropyl]-(2-pyridin-3-ylpiperazin-1-yl)methanone
CID 120730770
1-(2-methylpiperazin-1-yl)-2-phenylsulfanylethanone
CID 62672588
(2-cyclopropylcyclopropyl)-(2-methylpiperazin-1-yl)methanone
CID 119473712
2-methyl-1-(2-methylpiperazin-1-yl)-2-phenylpropan-1-one
CID 62673288
(7R)-1-[(1R,2S)-2-(4-fluorophenyl)cyclopropanecarbonyl]-7-phenyl-1,4-diazepan-5-one
CID 95283420
(1-benzoylpiperidin-4-yl)-(2-methylpiperazin-1-yl)methanone;hydrochloride
CID 119472389

Frequently Asked Questions

What is the IUPAC name of (2-methylpiperazin-1-yl)-(2-phenylcyclopropyl)methanone?
The IUPAC name of (2-methylpiperazin-1-yl)-(2-phenylcyclopropyl)methanone (CID 81478367) is (2-methylpiperazin-1-yl)-(2-phenylcyclopropyl)methanone.
What is the SMILES notation for (2-methylpiperazin-1-yl)-(2-phenylcyclopropyl)methanone?
The canonical SMILES for (2-methylpiperazin-1-yl)-(2-phenylcyclopropyl)methanone is CC1CNCCN1C(=O)C1CC1c1ccccc1.
What is the InChIKey of (2-methylpiperazin-1-yl)-(2-phenylcyclopropyl)methanone?
The InChIKey is GASDLZXYRIJQJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-11-10-16-7-8-17(11)15(18)14-9-13(14)12-5-3-2-4-6-12/h2-6,11,13-14,16H,7-10H2,1H3.
What are the key properties of (2-methylpiperazin-1-yl)-(2-phenylcyclopropyl)methanone?
(2-methylpiperazin-1-yl)-(2-phenylcyclopropyl)methanone has a molecular weight of 244.34 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpiperazin-1-yl)-(2-phenylcyclopropyl)methanone is sourced from PubChem (CID 81478367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).