6-[2-[cyclopropyl(ethyl)amino]ethylamino]pyridine-3-carboxamide

C13H20N4O — CID 113252356

IUPAC6-[2-[cyclopropyl(ethyl)amino]ethylamino]pyridine-3-carboxamide
SMILESCCN(CCNc1ccc(C(N)=O)cn1)C1CC1
InChIInChI=1S/C13H20N4O/c1-2-17(11-4-5-11)8-7-15-12-6-3-10(9-16-12)13(14)18/h3,6,9,11H,2,4-5,7-8H2,1H3,(H2,14,18)(H,15,16)
InChIKeyYRAOYRKFUJVWHT-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.08
Rot. Bonds7

About 6-[2-[cyclopropyl(ethyl)amino]ethylamino]pyridine-3-carboxamide

6-[2-[cyclopropyl(ethyl)amino]ethylamino]pyridine-3-carboxamide (PubChem CID 113252356) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 6-[2-[cyclopropyl(ethyl)amino]ethylamino]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[2-[cyclopropyl(ethyl)amino]ethylamino]pyridine-3-carboxamide
PubChem CID113252356
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name6-[2-[cyclopropyl(ethyl)amino]ethylamino]pyridine-3-carboxamide
SMILESCCN(CCNc1ccc(C(N)=O)cn1)C1CC1
InChIInChI=1S/C13H20N4O/c1-2-17(11-4-5-11)8-7-15-12-6-3-10(9-16-12)13(14)18/h3,6,9,11H,2,4-5,7-8H2,1H3,(H2,14,18)(H,15,16)
InChIKeyYRAOYRKFUJVWHT-UHFFFAOYSA-N
XLogP1.08
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[2-[methyl(propan-2-yl)amino]ethylamino]pyridine-3-carboxamide
CID 79830819
6-(hexylamino)pyridine-3-carboxamide
CID 112722796
N-methyl-N-(4-methylcyclohexyl)-6-(propylamino)pyridine-3-carboxamide
CID 62178480
6-[2-(propan-2-ylamino)ethylamino]pyridine-3-carboxamide
CID 62663227
1-[[(5-carbamoyl-2-pyridinyl)amino]methyl]-4-methylcyclohexane-1-carboxylic acid
CID 115441131
6-(4-hydroxybutylamino)pyridine-3-carboxamide
CID 106842705
N-cyclopropyl-N-ethyl-6-hydrazinylpyridine-3-carboxamide
CID 62241905
6-(5-methylhexylamino)pyridine-3-carboxamide
CID 79003295
6-[2-(dimethylamino)ethylamino]-N,N-diethylpyridine-3-carboxamide
CID 109153766
6-(3-methylsulfinylpropylamino)pyridine-3-carboxamide
CID 115631413
tert-butyl-[4-[(5-carbamoyl-2-pyridinyl)amino]cyclohexyl]carbamic acid
CID 67218167
6-(cyclopentylamino)pyridine-3-carboxamide
CID 112722808

Frequently Asked Questions

What is the IUPAC name of 6-[2-[cyclopropyl(ethyl)amino]ethylamino]pyridine-3-carboxamide?
The IUPAC name of 6-[2-[cyclopropyl(ethyl)amino]ethylamino]pyridine-3-carboxamide (CID 113252356) is 6-[2-[cyclopropyl(ethyl)amino]ethylamino]pyridine-3-carboxamide.
What is the SMILES notation for 6-[2-[cyclopropyl(ethyl)amino]ethylamino]pyridine-3-carboxamide?
The canonical SMILES for 6-[2-[cyclopropyl(ethyl)amino]ethylamino]pyridine-3-carboxamide is CCN(CCNc1ccc(C(N)=O)cn1)C1CC1.
What is the InChIKey of 6-[2-[cyclopropyl(ethyl)amino]ethylamino]pyridine-3-carboxamide?
The InChIKey is YRAOYRKFUJVWHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-2-17(11-4-5-11)8-7-15-12-6-3-10(9-16-12)13(14)18/h3,6,9,11H,2,4-5,7-8H2,1H3,(H2,14,18)(H,15,16).
What are the key properties of 6-[2-[cyclopropyl(ethyl)amino]ethylamino]pyridine-3-carboxamide?
6-[2-[cyclopropyl(ethyl)amino]ethylamino]pyridine-3-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.08, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[cyclopropyl(ethyl)amino]ethylamino]pyridine-3-carboxamide is sourced from PubChem (CID 113252356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).