N-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide

C15H24N4O2 — CID 81237252

IUPACN-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide
SMILESCCCNC(=O)CCNC(=O)c1cnccc1NCCC
InChIInChI=1S/C15H24N4O2/c1-3-7-17-13-5-9-16-11-12(13)15(21)19-10-6-14(20)18-8-4-2/h5,9,11H,3-4,6-8,10H2,1-2H3,(H,16,17)(H,18,20)(H,19,21)
InChIKeyFOOVREYNEGBLAM-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.55
Rot. Bonds9

About N-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide

N-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide (PubChem CID 81237252) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide
PubChem CID81237252
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide
SMILESCCCNC(=O)CCNC(=O)c1cnccc1NCCC
InChIInChI=1S/C15H24N4O2/c1-3-7-17-13-5-9-16-11-12(13)15(21)19-10-6-14(20)18-8-4-2/h5,9,11H,3-4,6-8,10H2,1-2H3,(H,16,17)(H,18,20)(H,19,21)
InChIKeyFOOVREYNEGBLAM-UHFFFAOYSA-N
XLogP1.55
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(carbamoylamino)ethyl]-4-(propylamino)pyridine-3-carboxamide
CID 83115001
N-[3-oxo-3-(propylamino)propyl]-2-(propylamino)benzamide
CID 62178281
N-[2-[ethyl(methyl)amino]ethyl]-4-(propylamino)pyridine-3-carboxamide
CID 81240941
N-(2-methylsulfonylethyl)-4-(propylamino)pyridine-3-carboxamide
CID 81234637
3-fluoro-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide
CID 115646395
N-[(3-methyl-4-pyridinyl)methyl]-4-(propylamino)pyridine-3-carboxamide
CID 114701819
4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
CID 81240630
N-(3-amino-3-oxopropyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81243085
N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-(propylamino)pyridine-3-carboxamide
CID 106280042
N-[2-(1-methylpyrazol-4-yl)ethyl]-4-(propylamino)pyridine-3-carboxamide
CID 81234341
4-(propylamino)-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 81241625
N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4-(propylamino)pyridine-3-carboxamide
CID 106422913

Frequently Asked Questions

What is the IUPAC name of N-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide (CID 81237252) is N-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide is CCCNC(=O)CCNC(=O)c1cnccc1NCCC.
What is the InChIKey of N-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide?
The InChIKey is FOOVREYNEGBLAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-3-7-17-13-5-9-16-11-12(13)15(21)19-10-6-14(20)18-8-4-2/h5,9,11H,3-4,6-8,10H2,1-2H3,(H,16,17)(H,18,20)(H,19,21).
What are the key properties of N-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide?
N-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.55, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 81237252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).