N-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide

C17H29N5O2 — CID 125446023

IUPACN-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide
SMILESCC[C@H](NC(=O)N1CCC(N2CCOCC2)CC1)c1ccnn1C
InChIInChI=1S/C17H29N5O2/c1-3-15(16-4-7-18-20(16)2)19-17(23)22-8-5-14(6-9-22)21-10-12-24-13-11-21/h4,7,14-15H,3,5-6,8-13H2,1-2H3,(H,19,23)/t15-/m0/s1
InChIKeyWNTIGHVJWSABFH-HNNXBMFYSA-N
MW335.45 g/mol
LogP1.38
Rot. Bonds4

About N-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide

N-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide (PubChem CID 125446023) has the molecular formula C17H29N5O2 and a molecular weight of 335.45 g/mol. Its IUPAC name is N-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide
PubChem CID125446023
Molecular FormulaC17H29N5O2
Molecular Weight335.45 g/mol
Exact Mass335.23
IUPAC NameN-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide
SMILESCC[C@H](NC(=O)N1CCC(N2CCOCC2)CC1)c1ccnn1C
InChIInChI=1S/C17H29N5O2/c1-3-15(16-4-7-18-20(16)2)19-17(23)22-8-5-14(6-9-22)21-10-12-24-13-11-21/h4,7,14-15H,3,5-6,8-13H2,1-2H3,(H,19,23)/t15-/m0/s1
InChIKeyWNTIGHVJWSABFH-HNNXBMFYSA-N
XLogP1.38
TPSA62.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.45
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide with MolForge

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Related Compounds

US11179399, Example 20
CID 163200024
US11179399, Example 20_1
CID 163200025
US11179399, Example 20_2
CID 163200026
US11179399, Example 21
CID 163200027
US11179399, Example 21_1
CID 163200028
US11179399, Example 21_2
CID 163200029
(3R*,5R*)-N-[2-(1-methyl-1H-pyrazol-5-yl)ethyl]-5-(morpholin-4-ylcarbonyl)piperidine-3-carboxamide
CID 72873135
N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-3-(morpholin-4-ylmethyl)piperidine-1-carboxamide
CID 72017984
2-(2-methoxyethoxy)-N-[1-(1-methyl-1H-pyrazol-5-yl)propyl]acetamide
CID 91785892
2,2,6,6-Tetramethyl-N-[2-(2-methylpyrazol-3-YL)ethyl]morpholine-4-carboxamide
CID 99825378
N-[(2R)-3-methyl-2-(2-methylpyrazol-3-yl)butyl]-5-oxa-8-azaspiro[3.5]nonane-8-carboxamide
CID 124847930
(3S)-N-[2-(1-methylpyrazol-3-yl)ethyl]-3-(morpholin-4-ylmethyl)piperidine-1-carboxamide
CID 128263827

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide?
The IUPAC name of N-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide (CID 125446023) is N-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide.
What is the SMILES notation for N-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide?
The canonical SMILES for N-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide is CC[C@H](NC(=O)N1CCC(N2CCOCC2)CC1)c1ccnn1C.
What is the InChIKey of N-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide?
The InChIKey is WNTIGHVJWSABFH-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H29N5O2/c1-3-15(16-4-7-18-20(16)2)19-17(23)22-8-5-14(6-9-22)21-10-12-24-13-11-21/h4,7,14-15H,3,5-6,8-13H2,1-2H3,(H,19,23)/t15-/m0/s1.
What are the key properties of N-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide?
N-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide has a molecular weight of 335.45 g/mol, XLogP of 1.38, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(2-methylpyrazol-3-yl)propyl]-4-morpholin-4-ylpiperidine-1-carboxamide is sourced from PubChem (CID 125446023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).