(2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide

C16H22N4O2S — CID 94036104

IUPAC(2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide
SMILESC[C@H](C(=O)NC[C@@H](c1cccs1)N1CCOCC1)n1cccn1
InChIInChI=1S/C16H22N4O2S/c1-13(20-6-3-5-18-20)16(21)17-12-14(15-4-2-11-23-15)19-7-9-22-10-8-19/h2-6,11,13-14H,7-10,12H2,1H3,(H,17,21)/t13-,14+/m1/s1
InChIKeyIKUMOZBDUIDDHH-KGLIPLIRSA-N
MW334.44 g/mol
LogP1.70
Rot. Bonds6

About (2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide

(2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide (PubChem CID 94036104) has the molecular formula C16H22N4O2S and a molecular weight of 334.44 g/mol. Its IUPAC name is (2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide.

Molecular Properties

Compound Name(2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide
PubChem CID94036104
Molecular FormulaC16H22N4O2S
Molecular Weight334.44 g/mol
Exact Mass334.15
IUPAC Name(2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide
SMILESC[C@H](C(=O)NC[C@@H](c1cccs1)N1CCOCC1)n1cccn1
InChIInChI=1S/C16H22N4O2S/c1-13(20-6-3-5-18-20)16(21)17-12-14(15-4-2-11-23-15)19-7-9-22-10-8-19/h2-6,11,13-14H,7-10,12H2,1H3,(H,17,21)/t13-,14+/m1/s1
InChIKeyIKUMOZBDUIDDHH-KGLIPLIRSA-N
XLogP1.70
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.44
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide with MolForge

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Related Compounds

3-amino-2-methyl-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)butanamide;dihydrochloride
CID 120502460
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)pyridine-4-carboxamide
CID 47007223
methyl N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)carbamate
CID 122265033
4-amino-3-methyl-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)butanamide
CID 81084360
2-amino-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(oxan-4-yl)acetamide
CID 120796894
1-amino-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)cyclopropane-1-carboxamide
CID 65464082
N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]prop-2-enamide
CID 7713761
N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyrrolidine-1-carboxamide
CID 94494130
(2R)-2-pyrazol-1-yl-N-[(1S)-1-thiophen-2-ylethyl]propanamide
CID 35699099
N-[(2S)-2-(4-methylpiperazin-1-yl)-2-thiophen-2-ylethyl]morpholine-4-carboxamide
CID 93159855
(2S)-N-[(2S)-2-(4-methylpiperidin-1-yl)-2-thiophen-2-ylethyl]-2-(1,2,4-triazol-1-yl)propanamide
CID 94042765
2-methyl-1-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-3-(2-pyrazol-1-ylethyl)guanidine
CID 111283875

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide?
The IUPAC name of (2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide (CID 94036104) is (2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide.
What is the SMILES notation for (2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide?
The canonical SMILES for (2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide is C[C@H](C(=O)NC[C@@H](c1cccs1)N1CCOCC1)n1cccn1.
What is the InChIKey of (2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide?
The InChIKey is IKUMOZBDUIDDHH-KGLIPLIRSA-N. The full InChI is InChI=1S/C16H22N4O2S/c1-13(20-6-3-5-18-20)16(21)17-12-14(15-4-2-11-23-15)19-7-9-22-10-8-19/h2-6,11,13-14H,7-10,12H2,1H3,(H,17,21)/t13-,14+/m1/s1.
What are the key properties of (2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide?
(2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide has a molecular weight of 334.44 g/mol, XLogP of 1.70, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-pyrazol-1-ylpropanamide is sourced from PubChem (CID 94036104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).