N-cyclopropyl-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide

C18H21N3O — CID 109179938

IUPACN-cyclopropyl-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide
SMILESCCc1cccc(C)c1Nc1ccc(C(=O)NC2CC2)nc1
InChIInChI=1S/C18H21N3O/c1-3-13-6-4-5-12(2)17(13)20-15-9-10-16(19-11-15)18(22)21-14-7-8-14/h4-6,9-11,14,20H,3,7-8H2,1-2H3,(H,21,22)
InChIKeyCXJKNIGNNWQJFO-UHFFFAOYSA-N
MW295.39 g/mol
LogP3.59
Rot. Bonds5

About N-cyclopropyl-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide

N-cyclopropyl-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide (PubChem CID 109179938) has the molecular formula C18H21N3O and a molecular weight of 295.39 g/mol. Its IUPAC name is N-cyclopropyl-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide
PubChem CID109179938
Molecular FormulaC18H21N3O
Molecular Weight295.39 g/mol
Exact Mass295.17
IUPAC NameN-cyclopropyl-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide
SMILESCCc1cccc(C)c1Nc1ccc(C(=O)NC2CC2)nc1
InChIInChI=1S/C18H21N3O/c1-3-13-6-4-5-12(2)17(13)20-15-9-10-16(19-11-15)18(22)21-14-7-8-14/h4-6,9-11,14,20H,3,7-8H2,1-2H3,(H,21,22)
InChIKeyCXJKNIGNNWQJFO-UHFFFAOYSA-N
XLogP3.59
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide?
The IUPAC name of N-cyclopropyl-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide (CID 109179938) is N-cyclopropyl-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide is CCc1cccc(C)c1Nc1ccc(C(=O)NC2CC2)nc1.
What is the InChIKey of N-cyclopropyl-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide?
The InChIKey is CXJKNIGNNWQJFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O/c1-3-13-6-4-5-12(2)17(13)20-15-9-10-16(19-11-15)18(22)21-14-7-8-14/h4-6,9-11,14,20H,3,7-8H2,1-2H3,(H,21,22).
What are the key properties of N-cyclopropyl-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide?
N-cyclopropyl-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide has a molecular weight of 295.39 g/mol, XLogP of 3.59, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-(2-ethyl-6-methylanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109179938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).