N-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide

C16H19N3O2 — CID 119516013

IUPACN-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide
SMILESCC(C)c1ccc(OCC(=O)Nc2ccc(N)nc2)cc1
InChIInChI=1S/C16H19N3O2/c1-11(2)12-3-6-14(7-4-12)21-10-16(20)19-13-5-8-15(17)18-9-13/h3-9,11H,10H2,1-2H3,(H2,17,18)(H,19,20)
InChIKeyDWMQKXKGCBIBSH-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.80
Rot. Bonds5

About N-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide

N-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide (PubChem CID 119516013) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide
PubChem CID119516013
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide
SMILESCC(C)c1ccc(OCC(=O)Nc2ccc(N)nc2)cc1
InChIInChI=1S/C16H19N3O2/c1-11(2)12-3-6-14(7-4-12)21-10-16(20)19-13-5-8-15(17)18-9-13/h3-9,11H,10H2,1-2H3,(H2,17,18)(H,19,20)
InChIKeyDWMQKXKGCBIBSH-UHFFFAOYSA-N
XLogP2.80
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-bromophenoxy)-N-(4-propan-2-ylphenyl)acetamide
CID 759062
N-[4-[[2-(4-propan-2-ylphenoxy)acetyl]amino]phenyl]butanamide
CID 17202439
N-(4-phenoxyphenyl)-2-(4-propan-2-ylphenoxy)acetamide
CID 1320918
N-[4-(3-methylbutoxy)phenyl]-2-(4-propan-2-ylphenoxy)acetamide
CID 4949733
ethyl 4-[[2-(4-propan-2-ylphenoxy)acetyl]amino]benzoate
CID 682450
N-propan-2-yl-4-[[2-(4-propan-2-ylphenoxy)acetyl]amino]benzamide
CID 26157459
2-(4-propan-2-ylphenoxy)acetohydrazide
CID 968935
N-(4-iodo-3,5-dimethylphenyl)-2-(4-propan-2-ylphenoxy)acetamide
CID 17336026
2-(3,5-dimethoxyphenoxy)-N-(4-propan-2-ylphenyl)acetamide
CID 7707185
[2-[4-(difluoromethoxy)anilino]-2-oxoethyl] 2-(4-propan-2-ylphenoxy)acetate
CID 8598019
N-[4-[5-(aminomethyl)-1H-1,2,4-triazol-3-yl]phenyl]-2-(4-propan-2-ylphenoxy)acetamide
CID 120566691
cyclohexyl 4-[[2-(4-propan-2-ylphenoxy)acetyl]amino]benzoate
CID 2788654

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide?
The IUPAC name of N-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide (CID 119516013) is N-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide?
The canonical SMILES for N-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide is CC(C)c1ccc(OCC(=O)Nc2ccc(N)nc2)cc1.
What is the InChIKey of N-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide?
The InChIKey is DWMQKXKGCBIBSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-11(2)12-3-6-14(7-4-12)21-10-16(20)19-13-5-8-15(17)18-9-13/h3-9,11H,10H2,1-2H3,(H2,17,18)(H,19,20).
What are the key properties of N-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide?
N-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide has a molecular weight of 285.35 g/mol, XLogP of 2.80, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-2-(4-propan-2-ylphenoxy)acetamide is sourced from PubChem (CID 119516013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).