N-(2,6-dimethoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide

C16H21N5O3 — CID 118763053

IUPACN-(2,6-dimethoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCCC(c3ccn[nH]3)C2)c(OC)n1
InChIInChI=1S/C16H21N5O3/c1-23-14-6-5-13(15(19-14)24-2)18-16(22)21-9-3-4-11(10-21)12-7-8-17-20-12/h5-8,11H,3-4,9-10H2,1-2H3,(H,17,20)(H,18,22)
InChIKeyQRYKXZZBDDYNDM-UHFFFAOYSA-N
MW331.38 g/mol
LogP2.23
Rot. Bonds4

About N-(2,6-dimethoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide

N-(2,6-dimethoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide (PubChem CID 118763053) has the molecular formula C16H21N5O3 and a molecular weight of 331.38 g/mol. Its IUPAC name is N-(2,6-dimethoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(2,6-dimethoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide
PubChem CID118763053
Molecular FormulaC16H21N5O3
Molecular Weight331.38 g/mol
Exact Mass331.16
IUPAC NameN-(2,6-dimethoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCCC(c3ccn[nH]3)C2)c(OC)n1
InChIInChI=1S/C16H21N5O3/c1-23-14-6-5-13(15(19-14)24-2)18-16(22)21-9-3-4-11(10-21)12-7-8-17-20-12/h5-8,11H,3-4,9-10H2,1-2H3,(H,17,20)(H,18,22)
InChIKeyQRYKXZZBDDYNDM-UHFFFAOYSA-N
XLogP2.23
TPSA92.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.38
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(3S)-N-[2-(4-methoxyphenyl)-5-methylpyrazol-3-yl]-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide
CID 97268219
1-[3-(1H-pyrazol-5-yl)piperidin-1-yl]ethanone
CID 62867071
(3R)-N-(2-methylquinolin-5-yl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide
CID 125164615
[1-(4-methoxyphenyl)cyclopentyl]-[3-(1H-pyrazol-5-yl)piperidin-1-yl]methanone
CID 56701547
N-[4-methoxy-3-(methylcarbamoyl)phenyl]-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide
CID 118762325
N-(4-phenylphenyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide
CID 166207366
2-(2-methoxyethylamino)-1-[3-(1H-pyrazol-5-yl)piperidin-1-yl]ethanone
CID 79281663
cyclopropyl-[3-(1H-pyrazol-5-yl)piperidin-1-yl]methanone
CID 62866717
(3R)-N-[(2S)-4-methoxy-4-methylpentan-2-yl]-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide
CID 124607594
(3R)-N-[(2S)-2-methoxy-3,3-dimethylbutyl]-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide
CID 124615298
3-(propan-2-ylamino)-1-[3-(1H-pyrazol-5-yl)piperidin-1-yl]propan-1-one
CID 54873257
(2-methylpyrazol-3-yl)-[3-(1H-pyrazol-5-yl)piperidin-1-yl]methanone
CID 110271023

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide?
The IUPAC name of N-(2,6-dimethoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide (CID 118763053) is N-(2,6-dimethoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-(2,6-dimethoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide?
The canonical SMILES for N-(2,6-dimethoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide is COc1ccc(NC(=O)N2CCCC(c3ccn[nH]3)C2)c(OC)n1.
What is the InChIKey of N-(2,6-dimethoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide?
The InChIKey is QRYKXZZBDDYNDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5O3/c1-23-14-6-5-13(15(19-14)24-2)18-16(22)21-9-3-4-11(10-21)12-7-8-17-20-12/h5-8,11H,3-4,9-10H2,1-2H3,(H,17,20)(H,18,22).
What are the key properties of N-(2,6-dimethoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide?
N-(2,6-dimethoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide has a molecular weight of 331.38 g/mol, XLogP of 2.23, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)piperidine-1-carboxamide is sourced from PubChem (CID 118763053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).