5-propyl-N,N-bis(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide

C19H25N5O — CID 75257558

IUPAC5-propyl-N,N-bis(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide
SMILESCCCC1CC(C(=O)N(Cc2cccnc2)Cc2cccnc2)NN1
InChIInChI=1S/C19H25N5O/c1-2-5-17-10-18(23-22-17)19(25)24(13-15-6-3-8-20-11-15)14-16-7-4-9-21-12-16/h3-4,6-9,11-12,17-18,22-23H,2,5,10,13-14H2,1H3
InChIKeyGFFZOGURBNWCHV-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.04
Rot. Bonds7

About 5-propyl-N,N-bis(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide

5-propyl-N,N-bis(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide (PubChem CID 75257558) has the molecular formula C19H25N5O and a molecular weight of 339.44 g/mol. Its IUPAC name is 5-propyl-N,N-bis(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide.

Molecular Properties

Compound Name5-propyl-N,N-bis(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide
PubChem CID75257558
Molecular FormulaC19H25N5O
Molecular Weight339.44 g/mol
Exact Mass339.21
IUPAC Name5-propyl-N,N-bis(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide
SMILESCCCC1CC(C(=O)N(Cc2cccnc2)Cc2cccnc2)NN1
InChIInChI=1S/C19H25N5O/c1-2-5-17-10-18(23-22-17)19(25)24(13-15-6-3-8-20-11-15)14-16-7-4-9-21-12-16/h3-4,6-9,11-12,17-18,22-23H,2,5,10,13-14H2,1H3
InChIKeyGFFZOGURBNWCHV-UHFFFAOYSA-N
XLogP2.04
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

cis-(1R,3S)-3-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 166254821
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CID 104901002
5-methyl-N-[[1-[(2-methylphenyl)methyl]piperidin-4-yl]methyl]-N-(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide
CID 74775024
2-[methyl(pyridin-3-ylmethyl)amino]-4-propylcyclohexane-1-carboxylic acid
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N-(pyridin-3-ylmethyl)propanehydrazide
CID 70312825
1-(2,2-dimethylpropanoyl)-N-[(4-ethylphenyl)methyl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide
CID 33324992
N-[(4-hydroxyphenyl)methyl]-2,7-dioxo-N-(pyridin-3-ylmethyl)-1,3-diazepane-4-carboxamide
CID 74241367
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2-phenyl-N-(pyridin-3-ylmethyl)-N-(pyridin-4-ylmethyl)cyclopropane-1-carboxamide
CID 71876328
(2S,4S)-N-(furan-2-ylmethyl)-2-methyl-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide;hydrochloride
CID 120640268
4-[[(2S,5R)-5-[(6-chloro-3-pyridinyl)methyl]pyrrolidin-2-yl]methyl]-N-ethyl-N-(pyridin-3-ylmethyl)benzamide
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CID 61155587

Frequently Asked Questions

What is the IUPAC name of 5-propyl-N,N-bis(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide?
The IUPAC name of 5-propyl-N,N-bis(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide (CID 75257558) is 5-propyl-N,N-bis(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide.
What is the SMILES notation for 5-propyl-N,N-bis(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide?
The canonical SMILES for 5-propyl-N,N-bis(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide is CCCC1CC(C(=O)N(Cc2cccnc2)Cc2cccnc2)NN1.
What is the InChIKey of 5-propyl-N,N-bis(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide?
The InChIKey is GFFZOGURBNWCHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O/c1-2-5-17-10-18(23-22-17)19(25)24(13-15-6-3-8-20-11-15)14-16-7-4-9-21-12-16/h3-4,6-9,11-12,17-18,22-23H,2,5,10,13-14H2,1H3.
What are the key properties of 5-propyl-N,N-bis(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide?
5-propyl-N,N-bis(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide has a molecular weight of 339.44 g/mol, XLogP of 2.04, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propyl-N,N-bis(pyridin-3-ylmethyl)pyrazolidine-3-carboxamide is sourced from PubChem (CID 75257558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).