4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide

C19H18N4O2 — CID 75371190

IUPAC4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide
SMILESO=C(CCCc1ccccn1)Nc1cccc(Oc2ncccn2)c1
InChIInChI=1S/C19H18N4O2/c24-18(10-4-7-15-6-1-2-11-20-15)23-16-8-3-9-17(14-16)25-19-21-12-5-13-22-19/h1-3,5-6,8-9,11-14H,4,7,10H2,(H,23,24)
InChIKeyWKSOXILQPLIVKW-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.63
Rot. Bonds7

About 4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide

4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide (PubChem CID 75371190) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is 4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide.

Molecular Properties

Compound Name4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide
PubChem CID75371190
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC Name4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide
SMILESO=C(CCCc1ccccn1)Nc1cccc(Oc2ncccn2)c1
InChIInChI=1S/C19H18N4O2/c24-18(10-4-7-15-6-1-2-11-20-15)23-16-8-3-9-17(14-16)25-19-21-12-5-13-22-19/h1-3,5-6,8-9,11-14H,4,7,10H2,(H,23,24)
InChIKeyWKSOXILQPLIVKW-UHFFFAOYSA-N
XLogP3.63
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-chloro-N-(3-phenoxyphenyl)butanamide
CID 63308949
3-pyridin-2-yl-N-pyridin-3-ylpropanamide
CID 47468155
N-[4-chloro-3-(trifluoromethyl)phenyl]-4-pyridin-2-ylbutanamide
CID 141052646
N-(3-methoxyphenyl)-4-phenylbutanamide
CID 683926
2-[3-[(2-pyridin-2-ylacetyl)amino]phenoxy]acetic acid
CID 61058458
N-(3-pyrimidin-2-yloxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 39261092
3-(3,5-dimethylphenoxy)-N-[3-(pyridin-2-ylmethoxy)phenyl]propanamide
CID 55653561
4-pyridin-2-yl-N-(3-pyridin-2-ylpropyl)butanamide
CID 166230056
4-phenoxy-N-[3-(2-pyridin-2-ylethynyl)phenyl]butanamide
CID 134053013
5-chloro-N-[2-(3-fluorophenoxy)pyrimidin-5-yl]pentanamide
CID 162507399
4-chloro-N-(3-pyrimidin-2-yloxyphenyl)benzamide
CID 39262452
N-(5-acetyl-2-chlorophenyl)-4-pyridin-2-ylbutanamide
CID 71917349

Frequently Asked Questions

What is the IUPAC name of 4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide?
The IUPAC name of 4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide (CID 75371190) is 4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide.
What is the SMILES notation for 4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide?
The canonical SMILES for 4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide is O=C(CCCc1ccccn1)Nc1cccc(Oc2ncccn2)c1.
What is the InChIKey of 4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide?
The InChIKey is WKSOXILQPLIVKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c24-18(10-4-7-15-6-1-2-11-20-15)23-16-8-3-9-17(14-16)25-19-21-12-5-13-22-19/h1-3,5-6,8-9,11-14H,4,7,10H2,(H,23,24).
What are the key properties of 4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide?
4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide has a molecular weight of 334.38 g/mol, XLogP of 3.63, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-2-yl-N-(3-pyrimidin-2-yloxyphenyl)butanamide is sourced from PubChem (CID 75371190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).