N-cyclopropyl-2-[4-[methyl-[(4-phenylphenyl)carbamoyl]amino]piperidin-1-yl]acetamide

C24H30N4O2 — CID 20782512

IUPACN-cyclopropyl-2-[4-[methyl-[(4-phenylphenyl)carbamoyl]amino]piperidin-1-yl]acetamide
SMILESCN(C(=O)Nc1ccc(-c2ccccc2)cc1)C1CCN(CC(=O)NC2CC2)CC1
InChIInChI=1S/C24H30N4O2/c1-27(22-13-15-28(16-14-22)17-23(29)25-20-11-12-20)24(30)26-21-9-7-19(8-10-21)18-5-3-2-4-6-18/h2-10,20,22H,11-17H2,1H3,(H,25,29)(H,26,30)
InChIKeyRRJOTOFLCCUFLF-UHFFFAOYSA-N
MW406.53 g/mol
LogP3.56
Rot. Bonds6

About N-cyclopropyl-2-[4-[methyl-[(4-phenylphenyl)carbamoyl]amino]piperidin-1-yl]acetamide

N-cyclopropyl-2-[4-[methyl-[(4-phenylphenyl)carbamoyl]amino]piperidin-1-yl]acetamide (PubChem CID 20782512) has the molecular formula C24H30N4O2 and a molecular weight of 406.53 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-[methyl-[(4-phenylphenyl)carbamoyl]amino]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-[methyl-[(4-phenylphenyl)carbamoyl]amino]piperidin-1-yl]acetamide
PubChem CID20782512
Molecular FormulaC24H30N4O2
Molecular Weight406.53 g/mol
Exact Mass406.24
IUPAC NameN-cyclopropyl-2-[4-[methyl-[(4-phenylphenyl)carbamoyl]amino]piperidin-1-yl]acetamide
SMILESCN(C(=O)Nc1ccc(-c2ccccc2)cc1)C1CCN(CC(=O)NC2CC2)CC1
InChIInChI=1S/C24H30N4O2/c1-27(22-13-15-28(16-14-22)17-23(29)25-20-11-12-20)24(30)26-21-9-7-19(8-10-21)18-5-3-2-4-6-18/h2-10,20,22H,11-17H2,1H3,(H,25,29)(H,26,30)
InChIKeyRRJOTOFLCCUFLF-UHFFFAOYSA-N
XLogP3.56
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.53
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-[methyl-[(4-phenylphenyl)carbamoyl]amino]piperidin-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[4-[methyl-[(4-phenylphenyl)carbamoyl]amino]piperidin-1-yl]acetamide (CID 20782512) is N-cyclopropyl-2-[4-[methyl-[(4-phenylphenyl)carbamoyl]amino]piperidin-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[4-[methyl-[(4-phenylphenyl)carbamoyl]amino]piperidin-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[4-[methyl-[(4-phenylphenyl)carbamoyl]amino]piperidin-1-yl]acetamide is CN(C(=O)Nc1ccc(-c2ccccc2)cc1)C1CCN(CC(=O)NC2CC2)CC1.
What is the InChIKey of N-cyclopropyl-2-[4-[methyl-[(4-phenylphenyl)carbamoyl]amino]piperidin-1-yl]acetamide?
The InChIKey is RRJOTOFLCCUFLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4O2/c1-27(22-13-15-28(16-14-22)17-23(29)25-20-11-12-20)24(30)26-21-9-7-19(8-10-21)18-5-3-2-4-6-18/h2-10,20,22H,11-17H2,1H3,(H,25,29)(H,26,30).
What are the key properties of N-cyclopropyl-2-[4-[methyl-[(4-phenylphenyl)carbamoyl]amino]piperidin-1-yl]acetamide?
N-cyclopropyl-2-[4-[methyl-[(4-phenylphenyl)carbamoyl]amino]piperidin-1-yl]acetamide has a molecular weight of 406.53 g/mol, XLogP of 3.56, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-[methyl-[(4-phenylphenyl)carbamoyl]amino]piperidin-1-yl]acetamide is sourced from PubChem (CID 20782512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).