3-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide

C19H25N5O2 — CID 56858466

IUPAC3-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide
SMILESCc1cc(C(=O)N2CCC(CCC(=O)NCc3cccnc3)CC2)n[nH]1
InChIInChI=1S/C19H25N5O2/c1-14-11-17(23-22-14)19(26)24-9-6-15(7-10-24)4-5-18(25)21-13-16-3-2-8-20-12-16/h2-3,8,11-12,15H,4-7,9-10,13H2,1H3,(H,21,25)(H,22,23)
InChIKeyIWDUHVHCJDDMOT-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.06
Rot. Bonds6

About 3-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide

3-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide (PubChem CID 56858466) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is 3-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide.

Molecular Properties

Compound Name3-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide
PubChem CID56858466
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC Name3-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide
SMILESCc1cc(C(=O)N2CCC(CCC(=O)NCc3cccnc3)CC2)n[nH]1
InChIInChI=1S/C19H25N5O2/c1-14-11-17(23-22-14)19(26)24-9-6-15(7-10-24)4-5-18(25)21-13-16-3-2-8-20-12-16/h2-3,8,11-12,15H,4-7,9-10,13H2,1H3,(H,21,25)(H,22,23)
InChIKeyIWDUHVHCJDDMOT-UHFFFAOYSA-N
XLogP2.06
TPSA90.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3R)-1-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 96573291
3-[1-(cyclohex-3-ene-1-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide
CID 45190596
3-[1-[3-(pyrazol-1-ylmethyl)benzoyl]piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide
CID 56719004
3-[1-(4-oxo-4-phenylbutanoyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide
CID 25289998
3-[1-(3-phenoxypropanoyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide
CID 42516784
(5-methyl-1H-pyrazol-3-yl)-[3-[methyl(pyridin-3-ylmethyl)amino]azetidin-1-yl]methanone
CID 110194784
2-[(3R)-3-(5-methyl-1H-pyrazol-3-yl)piperidin-1-yl]-N-(pyridin-3-ylmethyl)acetamide
CID 97004509
4-butyl-N-(pyridin-3-ylmethyl)piperidine-1-carboxamide
CID 23381452
N-[(3-chlorophenyl)methyl]-3-[1-(6-methylpyridine-3-carbonyl)piperidin-4-yl]propanamide
CID 42159544
3-[1-[(2,2-dimethyloxan-4-yl)methyl]piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide
CID 45236973
N-(pyridin-3-ylmethyl)-2-[1-(3,4,5-trimethoxybenzoyl)piperidin-4-yl]acetamide
CID 46295099
3-[1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide
CID 42288785

Frequently Asked Questions

What is the IUPAC name of 3-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide?
The IUPAC name of 3-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide (CID 56858466) is 3-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide.
What is the SMILES notation for 3-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide?
The canonical SMILES for 3-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide is Cc1cc(C(=O)N2CCC(CCC(=O)NCc3cccnc3)CC2)n[nH]1.
What is the InChIKey of 3-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide?
The InChIKey is IWDUHVHCJDDMOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-14-11-17(23-22-14)19(26)24-9-6-15(7-10-24)4-5-18(25)21-13-16-3-2-8-20-12-16/h2-3,8,11-12,15H,4-7,9-10,13H2,1H3,(H,21,25)(H,22,23).
What are the key properties of 3-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide?
3-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide has a molecular weight of 355.44 g/mol, XLogP of 2.06, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(5-methyl-1H-pyrazole-3-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide is sourced from PubChem (CID 56858466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).