N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-4-morpholin-4-ylbutanamide

C18H24N4O3 — CID 25029480

IUPACN-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-4-morpholin-4-ylbutanamide
SMILESCOc1cccc(-c2cc(NC(=O)CCCN3CCOCC3)n[nH]2)c1
InChIInChI=1S/C18H24N4O3/c1-24-15-5-2-4-14(12-15)16-13-17(21-20-16)19-18(23)6-3-7-22-8-10-25-11-9-22/h2,4-5,12-13H,3,6-11H2,1H3,(H2,19,20,21,23)
InChIKeySIAILDFYFZOUPJ-UHFFFAOYSA-N
MW344.42 g/mol
LogP2.14
Rot. Bonds7

About N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-4-morpholin-4-ylbutanamide

N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-4-morpholin-4-ylbutanamide (PubChem CID 25029480) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-4-morpholin-4-ylbutanamide.

Molecular Properties

Compound NameN-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-4-morpholin-4-ylbutanamide
PubChem CID25029480
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC NameN-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-4-morpholin-4-ylbutanamide
SMILESCOc1cccc(-c2cc(NC(=O)CCCN3CCOCC3)n[nH]2)c1
InChIInChI=1S/C18H24N4O3/c1-24-15-5-2-4-14(12-15)16-13-17(21-20-16)19-18(23)6-3-7-22-8-10-25-11-9-22/h2,4-5,12-13H,3,6-11H2,1H3,(H2,19,20,21,23)
InChIKeySIAILDFYFZOUPJ-UHFFFAOYSA-N
XLogP2.14
TPSA79.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(azepan-1-yl)-N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]butanamide
CID 25029479
N-[5-(3-fluoro-4-methoxyphenyl)-1H-pyrazol-3-yl]-4-(1,4-oxazepan-4-yl)butanamide
CID 59173856
N-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4-piperidin-1-ylbutanamide
CID 25029711
4-pyrrolidin-1-yl-N-[5-[3-(trifluoromethoxy)phenyl]-1H-pyrazol-3-yl]butanamide
CID 59173864
N-[5-(5-methoxy-3-pyridinyl)-1H-pyrazol-3-yl]-4-pyrrolidin-1-ylbutanamide
CID 44621198
formic acid;N-[5-(5-methoxy-3-pyridinyl)-1H-pyrazol-3-yl]-4-piperidin-1-ylbutanamide
CID 67188676
N-[5-(4-propan-2-yloxyphenyl)-1H-pyrazol-3-yl]-4-pyrrolidin-1-ylbutanamide
CID 59174009
N-[5-[4-(difluoromethoxy)-3-methoxyphenyl]-1H-pyrazol-3-yl]-4-pyrrolidin-1-ylbutanamide
CID 59173963
N-[5-[3-(difluoromethoxy)phenyl]-1H-pyrazol-3-yl]-4-(2-methylpyrrolidin-1-yl)butanamide
CID 59173788
N-[4-(3-methoxyphenyl)phenyl]-5-pyrrolidin-1-ylpentanamide
CID 59840445
5-(3-methoxyphenyl)-N-(3-morpholin-4-ylpropyl)-1,2-oxazole-3-carboxamide
CID 17252860
4-[[5-(3-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(3-morpholin-4-ylpropyl)butanamide
CID 42741736

Frequently Asked Questions

What is the IUPAC name of N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-4-morpholin-4-ylbutanamide?
The IUPAC name of N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-4-morpholin-4-ylbutanamide (CID 25029480) is N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-4-morpholin-4-ylbutanamide.
What is the SMILES notation for N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-4-morpholin-4-ylbutanamide?
The canonical SMILES for N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-4-morpholin-4-ylbutanamide is COc1cccc(-c2cc(NC(=O)CCCN3CCOCC3)n[nH]2)c1.
What is the InChIKey of N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-4-morpholin-4-ylbutanamide?
The InChIKey is SIAILDFYFZOUPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-24-15-5-2-4-14(12-15)16-13-17(21-20-16)19-18(23)6-3-7-22-8-10-25-11-9-22/h2,4-5,12-13H,3,6-11H2,1H3,(H2,19,20,21,23).
What are the key properties of N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-4-morpholin-4-ylbutanamide?
N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-4-morpholin-4-ylbutanamide has a molecular weight of 344.42 g/mol, XLogP of 2.14, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-4-morpholin-4-ylbutanamide is sourced from PubChem (CID 25029480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).