2-(ethylamino)-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide

C16H25N3O — CID 107420540

IUPAC2-(ethylamino)-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)NCC2CCCC2C)cc(C)n1
InChIInChI=1S/C16H25N3O/c1-4-17-15-9-14(8-12(3)19-15)16(20)18-10-13-7-5-6-11(13)2/h8-9,11,13H,4-7,10H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyMGHPBTFDQRWWPE-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.99
Rot. Bonds5

About 2-(ethylamino)-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide

2-(ethylamino)-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide (PubChem CID 107420540) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 2-(ethylamino)-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide
PubChem CID107420540
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name2-(ethylamino)-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)NCC2CCCC2C)cc(C)n1
InChIInChI=1S/C16H25N3O/c1-4-17-15-9-14(8-12(3)19-15)16(20)18-10-13-7-5-6-11(13)2/h8-9,11,13H,4-7,10H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyMGHPBTFDQRWWPE-UHFFFAOYSA-N
XLogP2.99
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide?
The IUPAC name of 2-(ethylamino)-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide (CID 107420540) is 2-(ethylamino)-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-(ethylamino)-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide?
The canonical SMILES for 2-(ethylamino)-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide is CCNc1cc(C(=O)NCC2CCCC2C)cc(C)n1.
What is the InChIKey of 2-(ethylamino)-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide?
The InChIKey is MGHPBTFDQRWWPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-4-17-15-9-14(8-12(3)19-15)16(20)18-10-13-7-5-6-11(13)2/h8-9,11,13H,4-7,10H2,1-3H3,(H,17,19)(H,18,20).
What are the key properties of 2-(ethylamino)-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide?
2-(ethylamino)-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide has a molecular weight of 275.40 g/mol, XLogP of 2.99, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-6-methyl-N-[(2-methylcyclopentyl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 107420540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).