[4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone

C18H24N2O2 — CID 109044208

IUPAC[4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone
SMILESCC1CCN(C(=O)c2ccc(C(=O)N3CCCC3)cc2)CC1
InChIInChI=1S/C18H24N2O2/c1-14-8-12-20(13-9-14)18(22)16-6-4-15(5-7-16)17(21)19-10-2-3-11-19/h4-7,14H,2-3,8-13H2,1H3
InChIKeyMRXQQCWDAZQOCG-UHFFFAOYSA-N
MW300.40 g/mol
LogP2.79
Rot. Bonds2

About [4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone

[4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone (PubChem CID 109044208) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is [4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone
PubChem CID109044208
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name[4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone
SMILESCC1CCN(C(=O)c2ccc(C(=O)N3CCCC3)cc2)CC1
InChIInChI=1S/C18H24N2O2/c1-14-8-12-20(13-9-14)18(22)16-6-4-15(5-7-16)17(21)19-10-2-3-11-19/h4-7,14H,2-3,8-13H2,1H3
InChIKeyMRXQQCWDAZQOCG-UHFFFAOYSA-N
XLogP2.79
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze [4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4-methylphenyl)-(4-methylpiperidin-1-yl)methanone
CID 723102
(4-methylazepan-1-yl)-[4-(trifluoromethyl)phenyl]methanone
CID 84581680
[4-(chloromethyl)phenyl]-(4-methylazepan-1-yl)methanone
CID 63622830
2-[4-(4-methylpiperidine-1-carbonyl)anilino]-1-piperidin-1-ylethanone
CID 54831366
N'-hydroxy-4-(4-methylazepane-1-carbonyl)benzenecarboximidamide
CID 77002526
[4-(azocane-1-carbonyl)phenyl]-(azocan-1-yl)methanone
CID 3317192
1-methyl-5-[(4S)-4-methylazepane-1-carbonyl]pyridin-2-one
CID 95591235
1-[4-(4-methylpiperidine-1-carbonyl)phenyl]-3-(2-oxo-2-pyrrolidin-1-ylethyl)urea
CID 60545834
(4-methylpiperidin-1-yl)-[4-(2-methylpropyl)phenyl]methanone
CID 86977180
2-(4-methylpiperidin-1-yl)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 54816946
(4-methylazepan-1-yl)-[4-(propylamino)phenyl]methanone
CID 63626184
(3aS,7aS)-2-[4-(4-methylpiperidine-1-carbonyl)phenyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CID 124526412

Frequently Asked Questions

What is the IUPAC name of [4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone (CID 109044208) is [4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone is CC1CCN(C(=O)c2ccc(C(=O)N3CCCC3)cc2)CC1.
What is the InChIKey of [4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone?
The InChIKey is MRXQQCWDAZQOCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-14-8-12-20(13-9-14)18(22)16-6-4-15(5-7-16)17(21)19-10-2-3-11-19/h4-7,14H,2-3,8-13H2,1H3.
What are the key properties of [4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone?
[4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone has a molecular weight of 300.40 g/mol, XLogP of 2.79, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-methylpiperidine-1-carbonyl)phenyl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 109044208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).