N-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide

C16H23N3O2 — CID 3288555

IUPACN-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide
SMILESCCC(C)(NC(=O)c1ccccn1)C(=O)NC1CCCC1
InChIInChI=1S/C16H23N3O2/c1-3-16(2,15(21)18-12-8-4-5-9-12)19-14(20)13-10-6-7-11-17-13/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,18,21)(H,19,20)
InChIKeyCEVHFFDQEVUOQB-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.04
Rot. Bonds5

About N-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide

N-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide (PubChem CID 3288555) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide
PubChem CID3288555
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide
SMILESCCC(C)(NC(=O)c1ccccn1)C(=O)NC1CCCC1
InChIInChI=1S/C16H23N3O2/c1-3-16(2,15(21)18-12-8-4-5-9-12)19-14(20)13-10-6-7-11-17-13/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,18,21)(H,19,20)
InChIKeyCEVHFFDQEVUOQB-UHFFFAOYSA-N
XLogP2.04
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide?
The IUPAC name of N-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide (CID 3288555) is N-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide.
What is the SMILES notation for N-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide?
The canonical SMILES for N-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide is CCC(C)(NC(=O)c1ccccn1)C(=O)NC1CCCC1.
What is the InChIKey of N-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide?
The InChIKey is CEVHFFDQEVUOQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-3-16(2,15(21)18-12-8-4-5-9-12)19-14(20)13-10-6-7-11-17-13/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,18,21)(H,19,20).
What are the key properties of N-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide?
N-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 2.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]pyridine-2-carboxamide is sourced from PubChem (CID 3288555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).