N-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide

C15H22N4O — CID 62173888

IUPACN-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ncccc1C(=O)NC1CCN(C2CC2)C1
InChIInChI=1S/C15H22N4O/c1-2-16-14-13(4-3-8-17-14)15(20)18-11-7-9-19(10-11)12-5-6-12/h3-4,8,11-12H,2,5-7,9-10H2,1H3,(H,16,17)(H,18,20)
InChIKeyAQNJJAPZGHZTRA-UHFFFAOYSA-N
MW274.37 g/mol
LogP1.48
Rot. Bonds5

About N-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide

N-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide (PubChem CID 62173888) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is N-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide
PubChem CID62173888
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC NameN-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ncccc1C(=O)NC1CCN(C2CC2)C1
InChIInChI=1S/C15H22N4O/c1-2-16-14-13(4-3-8-17-14)15(20)18-11-7-9-19(10-11)12-5-6-12/h3-4,8,11-12H,2,5-7,9-10H2,1H3,(H,16,17)(H,18,20)
InChIKeyAQNJJAPZGHZTRA-UHFFFAOYSA-N
XLogP1.48
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide (CID 62173888) is N-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide is CCNc1ncccc1C(=O)NC1CCN(C2CC2)C1.
What is the InChIKey of N-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide?
The InChIKey is AQNJJAPZGHZTRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-2-16-14-13(4-3-8-17-14)15(20)18-11-7-9-19(10-11)12-5-6-12/h3-4,8,11-12H,2,5-7,9-10H2,1H3,(H,16,17)(H,18,20).
What are the key properties of N-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide?
N-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide has a molecular weight of 274.37 g/mol, XLogP of 1.48, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62173888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).