piperidin-4-yl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone

C19H26N6O — CID 95821013

IUPACpiperidin-4-yl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone
SMILESO=C(C1CCNCC1)N1CCC(c2cc(Nc3ccccn3)n[nH]2)CC1
InChIInChI=1S/C19H26N6O/c26-19(15-4-9-20-10-5-15)25-11-6-14(7-12-25)16-13-18(24-23-16)22-17-3-1-2-8-21-17/h1-3,8,13-15,20H,4-7,9-12H2,(H2,21,22,23,24)
InChIKeyWHJSZCYMSTZNIU-UHFFFAOYSA-N
MW354.46 g/mol
LogP2.25
Rot. Bonds4

About piperidin-4-yl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone

piperidin-4-yl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone (PubChem CID 95821013) has the molecular formula C19H26N6O and a molecular weight of 354.46 g/mol. Its IUPAC name is piperidin-4-yl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone.

Molecular Properties

Compound Namepiperidin-4-yl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone
PubChem CID95821013
Molecular FormulaC19H26N6O
Molecular Weight354.46 g/mol
Exact Mass354.22
IUPAC Namepiperidin-4-yl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone
SMILESO=C(C1CCNCC1)N1CCC(c2cc(Nc3ccccn3)n[nH]2)CC1
InChIInChI=1S/C19H26N6O/c26-19(15-4-9-20-10-5-15)25-11-6-14(7-12-25)16-13-18(24-23-16)22-17-3-1-2-8-21-17/h1-3,8,13-15,20H,4-7,9-12H2,(H2,21,22,23,24)
InChIKeyWHJSZCYMSTZNIU-UHFFFAOYSA-N
XLogP2.25
TPSA85.94 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.46
LogP ≤ 52.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

phenyl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone
CID 95815306
cyclohexyl-[(2S)-2-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]pyrrolidin-1-yl]methanone
CID 95838089
tert-butyl 4-[2-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]pyrrolidine-1-carbonyl]piperidine-1-carboxylate
CID 110269760
cyclopropyl-[(3R)-3-(pyridin-2-ylamino)pyrrolidin-1-yl]methanone
CID 175863488
cyclohexyl-[3-[2-(pyridin-2-ylamino)pyrimidin-4-yl]pyrrolidin-1-yl]methanone
CID 155902293
N-(5-pyrrolidin-2-yl-1H-pyrazol-3-yl)pyridin-2-amine
CID 155906949
piperidin-4-yl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone;dihydrochloride
CID 119827947
cyclopentyl-[(3R)-3-[4-methyl-6-(pyridin-2-ylamino)pyrimidin-2-yl]piperidin-1-yl]methanone
CID 95820279
N-pyridin-2-yl-6-(1-pyrrolidin-1-ylsulfonylpiperidin-4-yl)pyridin-2-amine
CID 110093833
1-azabicyclo[2.2.2]octan-2-yl-[4-[3-(2-chlorophenyl)-1H-pyrazol-5-yl]piperidin-1-yl]methanone
CID 138808918
N-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-4-carboxamide;hydrochloride
CID 119329584
cyclohexyl-[(3R)-3-[5-(pyridin-2-ylamino)-2-pyridinyl]piperidin-1-yl]methanone
CID 95813574

Frequently Asked Questions

What is the IUPAC name of piperidin-4-yl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone?
The IUPAC name of piperidin-4-yl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone (CID 95821013) is piperidin-4-yl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone.
What is the SMILES notation for piperidin-4-yl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone?
The canonical SMILES for piperidin-4-yl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone is O=C(C1CCNCC1)N1CCC(c2cc(Nc3ccccn3)n[nH]2)CC1.
What is the InChIKey of piperidin-4-yl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone?
The InChIKey is WHJSZCYMSTZNIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6O/c26-19(15-4-9-20-10-5-15)25-11-6-14(7-12-25)16-13-18(24-23-16)22-17-3-1-2-8-21-17/h1-3,8,13-15,20H,4-7,9-12H2,(H2,21,22,23,24).
What are the key properties of piperidin-4-yl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone?
piperidin-4-yl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone has a molecular weight of 354.46 g/mol, XLogP of 2.25, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-4-yl-[4-[3-(pyridin-2-ylamino)-1H-pyrazol-5-yl]piperidin-1-yl]methanone is sourced from PubChem (CID 95821013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).