(2R)-N-(2-propan-2-ylpyrazol-3-yl)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide

C17H26N6O — CID 100836726

IUPAC(2R)-N-(2-propan-2-ylpyrazol-3-yl)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide
SMILESCC(C)n1nccc1NC(=O)[C@@H](C)N1CCC[C@@H](c2ccn[nH]2)C1
InChIInChI=1S/C17H26N6O/c1-12(2)23-16(7-9-19-23)20-17(24)13(3)22-10-4-5-14(11-22)15-6-8-18-21-15/h6-9,12-14H,4-5,10-11H2,1-3H3,(H,18,21)(H,20,24)/t13-,14-/m1/s1
InChIKeyKELOEMMFZQSIHB-ZIAGYGMSSA-N
MW330.44 g/mol
LogP2.39
Rot. Bonds5

About (2R)-N-(2-propan-2-ylpyrazol-3-yl)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide

(2R)-N-(2-propan-2-ylpyrazol-3-yl)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide (PubChem CID 100836726) has the molecular formula C17H26N6O and a molecular weight of 330.44 g/mol. Its IUPAC name is (2R)-N-(2-propan-2-ylpyrazol-3-yl)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide.

Molecular Properties

Compound Name(2R)-N-(2-propan-2-ylpyrazol-3-yl)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide
PubChem CID100836726
Molecular FormulaC17H26N6O
Molecular Weight330.44 g/mol
Exact Mass330.22
IUPAC Name(2R)-N-(2-propan-2-ylpyrazol-3-yl)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide
SMILESCC(C)n1nccc1NC(=O)[C@@H](C)N1CCC[C@@H](c2ccn[nH]2)C1
InChIInChI=1S/C17H26N6O/c1-12(2)23-16(7-9-19-23)20-17(24)13(3)22-10-4-5-14(11-22)15-6-8-18-21-15/h6-9,12-14H,4-5,10-11H2,1-3H3,(H,18,21)(H,20,24)/t13-,14-/m1/s1
InChIKeyKELOEMMFZQSIHB-ZIAGYGMSSA-N
XLogP2.39
TPSA78.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.44
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Launch Full Analysis

Related Compounds

(2S)-N-(5-chloro-2-pyridinyl)-2-[(3S)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide
CID 95760283
2-(azepan-1-yl)-N-(2-propan-2-ylpyrazol-3-yl)propanamide
CID 42913354
2-[[(2R)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanoyl]amino]thiophene-3-carboxamide
CID 100836744
(2S)-N-(3-cyano-4,5-dimethylfuran-2-yl)-2-[(3S)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide
CID 95760322
(2R)-2-[(3R)-3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-N-(2-propan-2-ylpyrazol-3-yl)propanamide
CID 37078163
(2S)-N-(5-propoxy-2-pyridinyl)-2-[3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide
CID 164584667
N-(5-butoxy-2-pyridinyl)-2-[3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide
CID 164584597
(2R)-2-[(2R)-2-methylmorpholin-4-yl]-N-(2-propan-2-ylpyrazol-3-yl)propanamide
CID 98716581
(2S)-N-(5-chloro-2-pyridinyl)-2-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]propanamide
CID 164584521
1-[3-(1H-pyrazol-5-yl)piperidin-1-yl]ethanone
CID 62867071
(2R)-2-[(3R)-3-acetamidopiperidin-1-yl]-N-[2-[(2S)-butan-2-yl]pyrazol-3-yl]propanamide
CID 100837005
2-[2-(4-fluorophenyl)morpholin-4-yl]-N-(2-propan-2-ylpyrazol-3-yl)propanamide
CID 46571508

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-propan-2-ylpyrazol-3-yl)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide?
The IUPAC name of (2R)-N-(2-propan-2-ylpyrazol-3-yl)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide (CID 100836726) is (2R)-N-(2-propan-2-ylpyrazol-3-yl)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide.
What is the SMILES notation for (2R)-N-(2-propan-2-ylpyrazol-3-yl)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide?
The canonical SMILES for (2R)-N-(2-propan-2-ylpyrazol-3-yl)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide is CC(C)n1nccc1NC(=O)[C@@H](C)N1CCC[C@@H](c2ccn[nH]2)C1.
What is the InChIKey of (2R)-N-(2-propan-2-ylpyrazol-3-yl)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide?
The InChIKey is KELOEMMFZQSIHB-ZIAGYGMSSA-N. The full InChI is InChI=1S/C17H26N6O/c1-12(2)23-16(7-9-19-23)20-17(24)13(3)22-10-4-5-14(11-22)15-6-8-18-21-15/h6-9,12-14H,4-5,10-11H2,1-3H3,(H,18,21)(H,20,24)/t13-,14-/m1/s1.
What are the key properties of (2R)-N-(2-propan-2-ylpyrazol-3-yl)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide?
(2R)-N-(2-propan-2-ylpyrazol-3-yl)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide has a molecular weight of 330.44 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2-propan-2-ylpyrazol-3-yl)-2-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]propanamide is sourced from PubChem (CID 100836726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).