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

C14H22N4O2 — CID 62176334

IUPAC2-(ethylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide
SMILESCCCNC(=O)CCNC(=O)c1ccnc(NCC)c1
InChIInChI=1S/C14H22N4O2/c1-3-7-17-13(19)6-9-18-14(20)11-5-8-16-12(10-11)15-4-2/h5,8,10H,3-4,6-7,9H2,1-2H3,(H,15,16)(H,17,19)(H,18,20)
InChIKeyRBBXWFAKCYLBNQ-UHFFFAOYSA-N
MW278.36 g/mol
LogP1.16
Rot. Bonds8

About 2-(ethylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide

2-(ethylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide (PubChem CID 62176334) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-(ethylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide
PubChem CID62176334
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name2-(ethylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide
SMILESCCCNC(=O)CCNC(=O)c1ccnc(NCC)c1
InChIInChI=1S/C14H22N4O2/c1-3-7-17-13(19)6-9-18-14(20)11-5-8-16-12(10-11)15-4-2/h5,8,10H,3-4,6-7,9H2,1-2H3,(H,15,16)(H,17,19)(H,18,20)
InChIKeyRBBXWFAKCYLBNQ-UHFFFAOYSA-N
XLogP1.16
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-butyl-2-(propylamino)pyridine-4-carboxamide
CID 62185279
N-[2-(dimethylcarbamoylamino)ethyl]-2-(ethylamino)pyridine-4-carboxamide
CID 83115069
N-(4-amino-4-oxobutyl)-2-(propylamino)pyridine-4-carboxamide
CID 55046885
2-(ethylamino)-N-(2-ethylsulfinylethyl)pyridine-4-carboxamide
CID 113252013
2-(methylamino)-N-[3-(methylamino)-3-oxopropyl]pyridine-4-carboxamide
CID 62175030
2-hydrazinyl-N-[2-oxo-2-(propylamino)ethyl]pyridine-4-carboxamide
CID 62243779
2-(ethylamino)-N-(5,5,5-trifluoropentyl)pyridine-4-carboxamide
CID 115492102
N-(2,2-dimethylpropyl)-2-(propylamino)pyridine-4-carboxamide
CID 62179912
N-propyl-2-[4-(propylcarbamoyl)-2-pyridinyl]pyridine-4-carboxamide
CID 57050532
N-[2-(diethylamino)ethyl]-2-(propylamino)pyridine-4-carboxamide
CID 62173284
2-[2-(4-chlorophenyl)ethylamino]-N-propylpyridine-4-carboxamide
CID 109165043
N-methyl-2-(propylamino)pyridine-4-carboxamide
CID 62170975

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide?
The IUPAC name of 2-(ethylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide (CID 62176334) is 2-(ethylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide is CCCNC(=O)CCNC(=O)c1ccnc(NCC)c1.
What is the InChIKey of 2-(ethylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide?
The InChIKey is RBBXWFAKCYLBNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-3-7-17-13(19)6-9-18-14(20)11-5-8-16-12(10-11)15-4-2/h5,8,10H,3-4,6-7,9H2,1-2H3,(H,15,16)(H,17,19)(H,18,20).
What are the key properties of 2-(ethylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide?
2-(ethylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide has a molecular weight of 278.36 g/mol, XLogP of 1.16, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide is sourced from PubChem (CID 62176334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).