N,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide

C17H23N5O — CID 124986213

IUPACN,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide
SMILESCc1nn(C)cc1C(=O)N(C)[C@@H]1CCCN(c2ccccn2)C1
InChIInChI=1S/C17H23N5O/c1-13-15(12-20(2)19-13)17(23)21(3)14-7-6-10-22(11-14)16-8-4-5-9-18-16/h4-5,8-9,12,14H,6-7,10-11H2,1-3H3/t14-/m1/s1
InChIKeyNWXXIIPXZQIXKP-CQSZACIVSA-N
MW313.41 g/mol
LogP1.86
Rot. Bonds3

About N,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide

N,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide (PubChem CID 124986213) has the molecular formula C17H23N5O and a molecular weight of 313.41 g/mol. Its IUPAC name is N,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide.

Molecular Properties

Compound NameN,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide
PubChem CID124986213
Molecular FormulaC17H23N5O
Molecular Weight313.41 g/mol
Exact Mass313.19
IUPAC NameN,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide
SMILESCc1nn(C)cc1C(=O)N(C)[C@@H]1CCCN(c2ccccn2)C1
InChIInChI=1S/C17H23N5O/c1-13-15(12-20(2)19-13)17(23)21(3)14-7-6-10-22(11-14)16-8-4-5-9-18-16/h4-5,8-9,12,14H,6-7,10-11H2,1-3H3/t14-/m1/s1
InChIKeyNWXXIIPXZQIXKP-CQSZACIVSA-N
XLogP1.86
TPSA54.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.41
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N,1,3-trimethyl-N-(1-pyridin-2-ylpiperidin-3-yl)pyrazole-4-carboxamide
CID 110107211
N,6-dimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-2-carboxamide
CID 124981919
N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide
CID 124952652
5-fluoro-2-methoxy-N-methyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]benzamide
CID 124952867
3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide
CID 125005100
N,1,3-trimethyl-2,6-dioxo-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrimidine-4-carboxamide
CID 124974957
3-imidazol-1-yl-N-methyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]propanamide
CID 124985299
N-methyl-3-(2-methylpyrazol-3-yl)-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]propanamide
CID 124997513
tert-butyl N-methyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]carbamate
CID 97166902
N,6-dimethyl-2-oxo-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]-1H-pyrimidine-4-carboxamide
CID 124974314
N-methyl-2-(5-methylthiophen-2-yl)-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]acetamide
CID 124975661
N-methyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1H-indole-2-carboxamide
CID 125008427

Frequently Asked Questions

What is the IUPAC name of N,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide?
The IUPAC name of N,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide (CID 124986213) is N,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide.
What is the SMILES notation for N,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide?
The canonical SMILES for N,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide is Cc1nn(C)cc1C(=O)N(C)[C@@H]1CCCN(c2ccccn2)C1.
What is the InChIKey of N,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide?
The InChIKey is NWXXIIPXZQIXKP-CQSZACIVSA-N. The full InChI is InChI=1S/C17H23N5O/c1-13-15(12-20(2)19-13)17(23)21(3)14-7-6-10-22(11-14)16-8-4-5-9-18-16/h4-5,8-9,12,14H,6-7,10-11H2,1-3H3/t14-/m1/s1.
What are the key properties of N,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide?
N,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide has a molecular weight of 313.41 g/mol, XLogP of 1.86, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide is sourced from PubChem (CID 124986213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).