N-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide

C20H27N5O — CID 100655227

IUPACN-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide
SMILESCCc1c(C(=O)NC[C@@H]2CCCCN2C2CC2)cnn1-c1ccccn1
InChIInChI=1S/C20H27N5O/c1-2-18-17(14-23-25(18)19-8-3-5-11-21-19)20(26)22-13-16-7-4-6-12-24(16)15-9-10-15/h3,5,8,11,14-16H,2,4,6-7,9-10,12-13H2,1H3,(H,22,26)/t16-/m0/s1
InChIKeySVZRBVGRVLHYFV-INIZCTEOSA-N
MW353.47 g/mol
LogP2.58
Rot. Bonds6

About N-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide

N-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide (PubChem CID 100655227) has the molecular formula C20H27N5O and a molecular weight of 353.47 g/mol. Its IUPAC name is N-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide
PubChem CID100655227
Molecular FormulaC20H27N5O
Molecular Weight353.47 g/mol
Exact Mass353.22
IUPAC NameN-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide
SMILESCCc1c(C(=O)NC[C@@H]2CCCCN2C2CC2)cnn1-c1ccccn1
InChIInChI=1S/C20H27N5O/c1-2-18-17(14-23-25(18)19-8-3-5-11-21-19)20(26)22-13-16-7-4-6-12-24(16)15-9-10-15/h3,5,8,11,14-16H,2,4,6-7,9-10,12-13H2,1H3,(H,22,26)/t16-/m0/s1
InChIKeySVZRBVGRVLHYFV-INIZCTEOSA-N
XLogP2.58
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.47
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide with MolForge

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Related Compounds

5-ethyl-N-[3-(4-ethylpiperazin-1-yl)propyl]-1-pyridin-2-ylpyrazole-4-carboxamide
CID 55660071
tert-butyl 3-[[(5-ethyl-1-pyridin-2-ylpyrazole-4-carbonyl)amino]methyl]piperidine-1-carboxylate
CID 60618230
5-ethyl-N-[3-(methylamino)propyl]-1-pyridin-2-ylpyrazole-4-carboxamide
CID 119433437
4-[(5-ethyl-1-pyridin-2-ylpyrazole-4-carbonyl)amino]butanoic acid
CID 119352538
N-(4-cyclopentylsulfanylphenyl)-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 38021535
N-[[2-[(dimethylamino)methyl]phenyl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 39043684
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 87043673
5-ethyl-N-(2-methylpiperidin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide
CID 120575667
5-ethyl-1-pyridin-2-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazole-4-carboxamide
CID 55604055
N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 55831374
5-ethyl-N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1-pyridin-2-ylpyrazole-4-carboxamide
CID 55604161
(5-ethyl-1-pyridin-2-ylpyrazol-4-yl)-[3-(methylaminomethyl)pyrrolidin-1-yl]methanone
CID 119541772

Frequently Asked Questions

What is the IUPAC name of N-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide?
The IUPAC name of N-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide (CID 100655227) is N-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide.
What is the SMILES notation for N-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide?
The canonical SMILES for N-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide is CCc1c(C(=O)NC[C@@H]2CCCCN2C2CC2)cnn1-c1ccccn1.
What is the InChIKey of N-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide?
The InChIKey is SVZRBVGRVLHYFV-INIZCTEOSA-N. The full InChI is InChI=1S/C20H27N5O/c1-2-18-17(14-23-25(18)19-8-3-5-11-21-19)20(26)22-13-16-7-4-6-12-24(16)15-9-10-15/h3,5,8,11,14-16H,2,4,6-7,9-10,12-13H2,1H3,(H,22,26)/t16-/m0/s1.
What are the key properties of N-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide?
N-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide has a molecular weight of 353.47 g/mol, XLogP of 2.58, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2S)-1-cyclopropylpiperidin-2-yl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide is sourced from PubChem (CID 100655227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).