4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide

C15H24N4O — CID 81240630

IUPAC4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
SMILESCCCNc1ccncc1C(=O)NCCN1CCCC1
InChIInChI=1S/C15H24N4O/c1-2-6-17-14-5-7-16-12-13(14)15(20)18-8-11-19-9-3-4-10-19/h5,7,12H,2-4,6,8-11H2,1H3,(H,16,17)(H,18,20)
InChIKeyJYWWXWAUTOSMDV-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.73
Rot. Bonds7

About 4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide

4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide (PubChem CID 81240630) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
PubChem CID81240630
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
SMILESCCCNc1ccncc1C(=O)NCCN1CCCC1
InChIInChI=1S/C15H24N4O/c1-2-6-17-14-5-7-16-12-13(14)15(20)18-8-11-19-9-3-4-10-19/h5,7,12H,2-4,6,8-11H2,1H3,(H,16,17)(H,18,20)
InChIKeyJYWWXWAUTOSMDV-UHFFFAOYSA-N
XLogP1.73
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-methylpiperidin-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide
CID 81238615
N-(2-piperidin-1-ylethyl)-2-(propylamino)benzamide
CID 62175413
4-(ethylamino)-N-(2-thiomorpholin-4-ylethyl)pyridine-3-carboxamide
CID 106327044
N-[2-(carbamoylamino)ethyl]-4-(propylamino)pyridine-3-carboxamide
CID 83115001
N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(propylamino)pyridine-3-carboxamide
CID 81234341
N-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide
CID 81237252
N-[2-[ethyl(methyl)amino]ethyl]-4-(propylamino)pyridine-3-carboxamide
CID 81240941
N-(2-methylsulfonylethyl)-4-(propylamino)pyridine-3-carboxamide
CID 81234637
3-(ethylamino)-N-(3-pyrrolidin-1-ylpropyl)pyridine-4-carboxamide
CID 105069979
N-[(3-methyl-4-pyridinyl)methyl]-4-(propylamino)pyridine-3-carboxamide
CID 114701819
N-morpholin-4-yl-4-(propylamino)pyridine-3-carboxamide
CID 83025351
N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide
CID 81245301

Frequently Asked Questions

What is the IUPAC name of 4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide?
The IUPAC name of 4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide (CID 81240630) is 4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide?
The canonical SMILES for 4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide is CCCNc1ccncc1C(=O)NCCN1CCCC1.
What is the InChIKey of 4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide?
The InChIKey is JYWWXWAUTOSMDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-2-6-17-14-5-7-16-12-13(14)15(20)18-8-11-19-9-3-4-10-19/h5,7,12H,2-4,6,8-11H2,1H3,(H,16,17)(H,18,20).
What are the key properties of 4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide?
4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.73, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 81240630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).