N-[5-(butan-2-ylamino)-2-pyridinyl]butanamide

C13H21N3O — CID 113024217

IUPACN-[5-(butan-2-ylamino)-2-pyridinyl]butanamide
SMILESCCCC(=O)Nc1ccc(NC(C)CC)cn1
InChIInChI=1S/C13H21N3O/c1-4-6-13(17)16-12-8-7-11(9-14-12)15-10(3)5-2/h7-10,15H,4-6H2,1-3H3,(H,14,16,17)
InChIKeyDJNZRKGZIQMYPQ-UHFFFAOYSA-N
MW235.33 g/mol
LogP3.03
Rot. Bonds6

About N-[5-(butan-2-ylamino)-2-pyridinyl]butanamide

N-[5-(butan-2-ylamino)-2-pyridinyl]butanamide (PubChem CID 113024217) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is N-[5-(butan-2-ylamino)-2-pyridinyl]butanamide.

Molecular Properties

Compound NameN-[5-(butan-2-ylamino)-2-pyridinyl]butanamide
PubChem CID113024217
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC NameN-[5-(butan-2-ylamino)-2-pyridinyl]butanamide
SMILESCCCC(=O)Nc1ccc(NC(C)CC)cn1
InChIInChI=1S/C13H21N3O/c1-4-6-13(17)16-12-8-7-11(9-14-12)15-10(3)5-2/h7-10,15H,4-6H2,1-3H3,(H,14,16,17)
InChIKeyDJNZRKGZIQMYPQ-UHFFFAOYSA-N
XLogP3.03
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-[5-(butan-2-ylamino)-2-pyridinyl]butanamide
CID 82034192
2-amino-N-[5-(butan-2-ylamino)-2-pyridinyl]acetamide
CID 82034084
N-[4-(butan-2-ylamino)phenyl]butanamide
CID 112980445
N-[5-(1-phenylethylamino)-2-pyridinyl]butanamide
CID 113026778
N-[5-(butan-2-ylamino)-2-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113024277
2-(2-bromophenyl)-N-[5-(butan-2-ylamino)-2-pyridinyl]acetamide
CID 113024287
N-[6-(butanoylamino)-3-pyridinyl]-2,2-dimethylpropanamide
CID 1452758
N-[5-(butan-2-ylamino)-2-pyridinyl]-2-fluorobenzamide
CID 113024232
2-(3-bromophenyl)-N-[5-(butan-2-ylamino)-2-pyridinyl]acetamide
CID 113024286
N-[6-(pentanoylamino)-3-pyridinyl]pentanamide
CID 649725
N-[5-(butan-2-ylamino)-2-pyridinyl]pyridine-3-carboxamide
CID 113024266
N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]butanamide
CID 113027859

Frequently Asked Questions

What is the IUPAC name of N-[5-(butan-2-ylamino)-2-pyridinyl]butanamide?
The IUPAC name of N-[5-(butan-2-ylamino)-2-pyridinyl]butanamide (CID 113024217) is N-[5-(butan-2-ylamino)-2-pyridinyl]butanamide.
What is the SMILES notation for N-[5-(butan-2-ylamino)-2-pyridinyl]butanamide?
The canonical SMILES for N-[5-(butan-2-ylamino)-2-pyridinyl]butanamide is CCCC(=O)Nc1ccc(NC(C)CC)cn1.
What is the InChIKey of N-[5-(butan-2-ylamino)-2-pyridinyl]butanamide?
The InChIKey is DJNZRKGZIQMYPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-4-6-13(17)16-12-8-7-11(9-14-12)15-10(3)5-2/h7-10,15H,4-6H2,1-3H3,(H,14,16,17).
What are the key properties of N-[5-(butan-2-ylamino)-2-pyridinyl]butanamide?
N-[5-(butan-2-ylamino)-2-pyridinyl]butanamide has a molecular weight of 235.33 g/mol, XLogP of 3.03, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(butan-2-ylamino)-2-pyridinyl]butanamide is sourced from PubChem (CID 113024217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).