N-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide

C23H24N2O3 — CID 55903636

IUPACN-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide
SMILESO=C(NC1CC1)C1CCN(C(=O)C2c3ccccc3Oc3ccccc32)CC1
InChIInChI=1S/C23H24N2O3/c26-22(24-16-9-10-16)15-11-13-25(14-12-15)23(27)21-17-5-1-3-7-19(17)28-20-8-4-2-6-18(20)21/h1-8,15-16,21H,9-14H2,(H,24,26)
InChIKeyXDPWHUKTKSDLOL-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.44
Rot. Bonds3

About N-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide

N-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide (PubChem CID 55903636) has the molecular formula C23H24N2O3 and a molecular weight of 376.46 g/mol. Its IUPAC name is N-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide
PubChem CID55903636
Molecular FormulaC23H24N2O3
Molecular Weight376.46 g/mol
Exact Mass376.18
IUPAC NameN-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide
SMILESO=C(NC1CC1)C1CCN(C(=O)C2c3ccccc3Oc3ccccc32)CC1
InChIInChI=1S/C23H24N2O3/c26-22(24-16-9-10-16)15-11-13-25(14-12-15)23(27)21-17-5-1-3-7-19(17)28-20-8-4-2-6-18(20)21/h1-8,15-16,21H,9-14H2,(H,24,26)
InChIKeyXDPWHUKTKSDLOL-UHFFFAOYSA-N
XLogP3.44
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide 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

methyl 1-(9H-xanthene-9-carbonyl)piperidine-4-carboxylate
CID 1147765
(4-methylpiperidin-1-yl)-[1-(9H-xanthene-9-carbonyl)piperidin-4-yl]methanone
CID 55950323
(4-methylsulfonylpiperidin-1-yl)-(9H-xanthen-9-yl)methanone
CID 71805694
N-cyclohexyl-9H-xanthene-9-carboxamide
CID 718107
2-methylpropyl 4-(9H-xanthen-9-ylcarbamoyl)piperidine-1-carboxylate
CID 56547669
(4-methyl-1,4-diazepan-1-yl)-(9H-xanthen-9-yl)methanone
CID 17164721
1,4-dioxa-8-azaspiro[4.5]decan-8-yl(9H-xanthen-9-yl)methanone
CID 1246532
N-cyclopropyl-1-[1-[(3R)-3,4-dihydro-2H-chromene-3-carbonyl]piperidin-4-yl]piperidine-4-carboxamide
CID 25461334
(4-cyclobutyl-1,4-diazepan-1-yl)-(9H-xanthen-9-yl)methanone
CID 131703888
1-(cyclopropanecarbonyl)-N-(1-phenylpiperidin-4-yl)piperidine-4-carboxamide
CID 72921042
[3-(hydroxymethyl)azetidin-1-yl]-(9H-xanthen-9-yl)methanone
CID 121105783
[4-[3-(aminomethyl)phenyl]piperidin-1-yl]-(9H-xanthen-9-yl)methanone
CID 23587391

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide (CID 55903636) is N-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide is O=C(NC1CC1)C1CCN(C(=O)C2c3ccccc3Oc3ccccc32)CC1.
What is the InChIKey of N-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide?
The InChIKey is XDPWHUKTKSDLOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3/c26-22(24-16-9-10-16)15-11-13-25(14-12-15)23(27)21-17-5-1-3-7-19(17)28-20-8-4-2-6-18(20)21/h1-8,15-16,21H,9-14H2,(H,24,26).
What are the key properties of N-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide?
N-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(9H-xanthene-9-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 55903636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).