4-amino-N-[6-[2-(4-hydroxyphenyl)ethylamino]-3-pyridinyl]butanamide

C17H22N4O2 — CID 39179034

IUPAC4-amino-N-[6-[2-(4-hydroxyphenyl)ethylamino]-3-pyridinyl]butanamide
SMILESNCCCC(=O)Nc1ccc(NCCc2ccc(O)cc2)nc1
InChIInChI=1S/C17H22N4O2/c18-10-1-2-17(23)21-14-5-8-16(20-12-14)19-11-9-13-3-6-15(22)7-4-13/h3-8,12,22H,1-2,9-11,18H2,(H,19,20)(H,21,23)
InChIKeySNXLFIYIRPRPAB-UHFFFAOYSA-N
MW314.39 g/mol
LogP2.12
Rot. Bonds8

About 4-amino-N-[6-[2-(4-hydroxyphenyl)ethylamino]-3-pyridinyl]butanamide

4-amino-N-[6-[2-(4-hydroxyphenyl)ethylamino]-3-pyridinyl]butanamide (PubChem CID 39179034) has the molecular formula C17H22N4O2 and a molecular weight of 314.39 g/mol. Its IUPAC name is 4-amino-N-[6-[2-(4-hydroxyphenyl)ethylamino]-3-pyridinyl]butanamide.

Molecular Properties

Compound Name4-amino-N-[6-[2-(4-hydroxyphenyl)ethylamino]-3-pyridinyl]butanamide
PubChem CID39179034
Molecular FormulaC17H22N4O2
Molecular Weight314.39 g/mol
Exact Mass314.17
IUPAC Name4-amino-N-[6-[2-(4-hydroxyphenyl)ethylamino]-3-pyridinyl]butanamide
SMILESNCCCC(=O)Nc1ccc(NCCc2ccc(O)cc2)nc1
InChIInChI=1S/C17H22N4O2/c18-10-1-2-17(23)21-14-5-8-16(20-12-14)19-11-9-13-3-6-15(22)7-4-13/h3-8,12,22H,1-2,9-11,18H2,(H,19,20)(H,21,23)
InChIKeySNXLFIYIRPRPAB-UHFFFAOYSA-N
XLogP2.12
TPSA100.27 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 52.12
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-[6-(2-methylpropylamino)-3-pyridinyl]butanamide
CID 39179065
4-amino-N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]butanamide
CID 39187538
N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-3-phenoxypropanamide
CID 113013478
3-phenyl-N-[5-(2-phenylethylamino)-2-pyridinyl]propanamide
CID 113028011
4-amino-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]butanamide
CID 82034236
N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide
CID 113013483
2-amino-N-[6-(5-hydroxypentylamino)-3-pyridinyl]acetamide
CID 39179919
N-[6-(3-methylbutylamino)-3-pyridinyl]pentanamide
CID 113015062
N-[6-(3-methylbutylamino)-3-pyridinyl]-3-phenylpropanamide
CID 113015098
N-[6-(2-hydroxyethylamino)-3-pyridinyl]butanamide
CID 28903424
N-[6-(pentanoylamino)-3-pyridinyl]pentanamide
CID 649725
4-amino-N-[5-(butan-2-ylamino)-2-pyridinyl]butanamide
CID 82034192

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[6-[2-(4-hydroxyphenyl)ethylamino]-3-pyridinyl]butanamide?
The IUPAC name of 4-amino-N-[6-[2-(4-hydroxyphenyl)ethylamino]-3-pyridinyl]butanamide (CID 39179034) is 4-amino-N-[6-[2-(4-hydroxyphenyl)ethylamino]-3-pyridinyl]butanamide.
What is the SMILES notation for 4-amino-N-[6-[2-(4-hydroxyphenyl)ethylamino]-3-pyridinyl]butanamide?
The canonical SMILES for 4-amino-N-[6-[2-(4-hydroxyphenyl)ethylamino]-3-pyridinyl]butanamide is NCCCC(=O)Nc1ccc(NCCc2ccc(O)cc2)nc1.
What is the InChIKey of 4-amino-N-[6-[2-(4-hydroxyphenyl)ethylamino]-3-pyridinyl]butanamide?
The InChIKey is SNXLFIYIRPRPAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O2/c18-10-1-2-17(23)21-14-5-8-16(20-12-14)19-11-9-13-3-6-15(22)7-4-13/h3-8,12,22H,1-2,9-11,18H2,(H,19,20)(H,21,23).
What are the key properties of 4-amino-N-[6-[2-(4-hydroxyphenyl)ethylamino]-3-pyridinyl]butanamide?
4-amino-N-[6-[2-(4-hydroxyphenyl)ethylamino]-3-pyridinyl]butanamide has a molecular weight of 314.39 g/mol, XLogP of 2.12, 8 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[6-[2-(4-hydroxyphenyl)ethylamino]-3-pyridinyl]butanamide is sourced from PubChem (CID 39179034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).