N-methyl-5-pyridin-2-yl-N-(quinolin-5-ylmethyl)pyrazolidine-3-carboxamide

C20H21N5O — CID 75261619

IUPACN-methyl-5-pyridin-2-yl-N-(quinolin-5-ylmethyl)pyrazolidine-3-carboxamide
SMILESCN(Cc1cccc2ncccc12)C(=O)C1CC(c2ccccn2)NN1
InChIInChI=1S/C20H21N5O/c1-25(13-14-6-4-9-16-15(14)7-5-11-21-16)20(26)19-12-18(23-24-19)17-8-2-3-10-22-17/h2-11,18-19,23-24H,12-13H2,1H3
InChIKeyNGEPMIRYCDYEGI-UHFFFAOYSA-N
MW347.42 g/mol
LogP2.20
Rot. Bonds4

About N-methyl-5-pyridin-2-yl-N-(quinolin-5-ylmethyl)pyrazolidine-3-carboxamide

N-methyl-5-pyridin-2-yl-N-(quinolin-5-ylmethyl)pyrazolidine-3-carboxamide (PubChem CID 75261619) has the molecular formula C20H21N5O and a molecular weight of 347.42 g/mol. Its IUPAC name is N-methyl-5-pyridin-2-yl-N-(quinolin-5-ylmethyl)pyrazolidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-5-pyridin-2-yl-N-(quinolin-5-ylmethyl)pyrazolidine-3-carboxamide
PubChem CID75261619
Molecular FormulaC20H21N5O
Molecular Weight347.42 g/mol
Exact Mass347.17
IUPAC NameN-methyl-5-pyridin-2-yl-N-(quinolin-5-ylmethyl)pyrazolidine-3-carboxamide
SMILESCN(Cc1cccc2ncccc12)C(=O)C1CC(c2ccccn2)NN1
InChIInChI=1S/C20H21N5O/c1-25(13-14-6-4-9-16-15(14)7-5-11-21-16)20(26)19-12-18(23-24-19)17-8-2-3-10-22-17/h2-11,18-19,23-24H,12-13H2,1H3
InChIKeyNGEPMIRYCDYEGI-UHFFFAOYSA-N
XLogP2.20
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

propan-2-yl N-methyl-N-(quinolin-5-ylmethyl)carbamate
CID 135388422
2-(2-methoxyphenyl)-N-methyl-N-(quinolin-5-ylmethyl)acetamide
CID 70744785
(2S)-2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-(quinolin-5-ylmethyl)acetamide
CID 97188254
N-benzyl-N-methyl-5-phenylpyrazolidine-3-carboxamide
CID 78419071
2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-(quinolin-5-ylmethyl)acetamide
CID 56905403
N-[2-[methyl(quinolin-5-ylmethyl)amino]-2-oxoethyl]benzamide
CID 70751619
3-[6-[methyl(quinolin-5-ylmethyl)amino]pyrimidin-4-yl]cyclobutan-1-ol
CID 91785441
3-(benzenesulfonyl)-N-methyl-N-(quinolin-5-ylmethyl)propanamide
CID 70709829
N-methyl-2-oxo-6-phenyl-N-(quinolin-5-ylmethyl)-1H-pyridine-3-carboxamide
CID 56908393
[2-[(2-fluorophenyl)methyl-methylamino]-2-oxoethyl] quinoline-5-carboxylate
CID 55562613
N-(4-acetamidophenyl)-5-pyridin-2-ylpyrazolidine-3-carboxamide
CID 75188084
ethane;5-ethylquinoline
CID 143401043

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-pyridin-2-yl-N-(quinolin-5-ylmethyl)pyrazolidine-3-carboxamide?
The IUPAC name of N-methyl-5-pyridin-2-yl-N-(quinolin-5-ylmethyl)pyrazolidine-3-carboxamide (CID 75261619) is N-methyl-5-pyridin-2-yl-N-(quinolin-5-ylmethyl)pyrazolidine-3-carboxamide.
What is the SMILES notation for N-methyl-5-pyridin-2-yl-N-(quinolin-5-ylmethyl)pyrazolidine-3-carboxamide?
The canonical SMILES for N-methyl-5-pyridin-2-yl-N-(quinolin-5-ylmethyl)pyrazolidine-3-carboxamide is CN(Cc1cccc2ncccc12)C(=O)C1CC(c2ccccn2)NN1.
What is the InChIKey of N-methyl-5-pyridin-2-yl-N-(quinolin-5-ylmethyl)pyrazolidine-3-carboxamide?
The InChIKey is NGEPMIRYCDYEGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O/c1-25(13-14-6-4-9-16-15(14)7-5-11-21-16)20(26)19-12-18(23-24-19)17-8-2-3-10-22-17/h2-11,18-19,23-24H,12-13H2,1H3.
What are the key properties of N-methyl-5-pyridin-2-yl-N-(quinolin-5-ylmethyl)pyrazolidine-3-carboxamide?
N-methyl-5-pyridin-2-yl-N-(quinolin-5-ylmethyl)pyrazolidine-3-carboxamide has a molecular weight of 347.42 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-pyridin-2-yl-N-(quinolin-5-ylmethyl)pyrazolidine-3-carboxamide is sourced from PubChem (CID 75261619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).