2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide

C12H18N4O2 — CID 62168328

IUPAC2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide
SMILESCCNC(=O)CNC(=O)c1cccnc1NCC
InChIInChI=1S/C12H18N4O2/c1-3-13-10(17)8-16-12(18)9-6-5-7-15-11(9)14-4-2/h5-7H,3-4,8H2,1-2H3,(H,13,17)(H,14,15)(H,16,18)
InChIKeyUZNSHMZWEZGUJN-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.38
Rot. Bonds6

About 2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide

2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide (PubChem CID 62168328) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is 2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide
PubChem CID62168328
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC Name2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide
SMILESCCNC(=O)CNC(=O)c1cccnc1NCC
InChIInChI=1S/C12H18N4O2/c1-3-13-10(17)8-16-12(18)9-6-5-7-15-11(9)14-4-2/h5-7H,3-4,8H2,1-2H3,(H,13,17)(H,14,15)(H,16,18)
InChIKeyUZNSHMZWEZGUJN-UHFFFAOYSA-N
XLogP0.38
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-3-carboxamide
CID 62178636
2-(ethylamino)-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 62173151
2-(ethylamino)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 62165958
2-(ethylamino)-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 63247950
2-(ethylamino)-N-(5,5,5-trifluoropentyl)pyridine-3-carboxamide
CID 115522135
N-[(4-cyanophenyl)methyl]-2-(ethylamino)pyridine-3-carboxamide
CID 62269325
N-[2-[cyclopropyl(methyl)amino]ethyl]-2-(ethylamino)pyridine-3-carboxamide
CID 62978746
2-(ethylamino)-N-[(4-methyl-3-pyridinyl)methyl]pyridine-3-carboxamide
CID 114957515
2-(ethylamino)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyridine-3-carboxamide
CID 106377114
2-(ethylamino)-N-pyrimidin-5-ylpyridine-3-carboxamide
CID 107589901
N-[2-(ethylamino)-2-oxoethyl]-3-fluoro-2-(propylamino)pyridine-4-carboxamide
CID 105384867
2-(ethylamino)-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-carboxamide
CID 63824011

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide?
The IUPAC name of 2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide (CID 62168328) is 2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide is CCNC(=O)CNC(=O)c1cccnc1NCC.
What is the InChIKey of 2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide?
The InChIKey is UZNSHMZWEZGUJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c1-3-13-10(17)8-16-12(18)9-6-5-7-15-11(9)14-4-2/h5-7H,3-4,8H2,1-2H3,(H,13,17)(H,14,15)(H,16,18).
What are the key properties of 2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide?
2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide has a molecular weight of 250.30 g/mol, XLogP of 0.38, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide is sourced from PubChem (CID 62168328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).