4-imidazol-1-yl-N-(1H-pyrazol-4-yl)butanamide

C10H13N5O — CID 166195192

IUPAC4-imidazol-1-yl-N-(1H-pyrazol-4-yl)butanamide
SMILESO=C(CCCn1ccnc1)Nc1cn[nH]c1
InChIInChI=1S/C10H13N5O/c16-10(14-9-6-12-13-7-9)2-1-4-15-5-3-11-8-15/h3,5-8H,1-2,4H2,(H,12,13)(H,14,16)
InChIKeyVDFSNQIWQAOPHF-UHFFFAOYSA-N
MW219.25 g/mol
LogP1.03
Rot. Bonds5

About 4-imidazol-1-yl-N-(1H-pyrazol-4-yl)butanamide

4-imidazol-1-yl-N-(1H-pyrazol-4-yl)butanamide (PubChem CID 166195192) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is 4-imidazol-1-yl-N-(1H-pyrazol-4-yl)butanamide.

Molecular Properties

Compound Name4-imidazol-1-yl-N-(1H-pyrazol-4-yl)butanamide
PubChem CID166195192
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC Name4-imidazol-1-yl-N-(1H-pyrazol-4-yl)butanamide
SMILESO=C(CCCn1ccnc1)Nc1cn[nH]c1
InChIInChI=1S/C10H13N5O/c16-10(14-9-6-12-13-7-9)2-1-4-15-5-3-11-8-15/h3,5-8H,1-2,4H2,(H,12,13)(H,14,16)
InChIKeyVDFSNQIWQAOPHF-UHFFFAOYSA-N
XLogP1.03
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-N-(1H-pyrazol-4-yl)pentanamide
CID 107908291
3-imidazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide
CID 61000051
N-(3,4-dimethoxyphenyl)-5-imidazol-1-ylpentanamide
CID 11558534
3-imidazol-1-yl-N-(1H-pyrazol-4-yl)hexanamide
CID 43430739
N-(4-hydroxyphenyl)-3-imidazol-1-ylpropanamide
CID 28739593
6-[4-(4-imidazol-1-ylbutanoylamino)phenoxy]-2,2-dimethylhexanoic acid
CID 13422045
4-imidazol-1-yl-N-[4-(2-propan-2-ylimidazol-1-yl)phenyl]butanamide
CID 46970439
N-(6-bromo-3-pyridinyl)-3-imidazol-1-ylpropanamide
CID 103789490
2-hydroxy-N-(1H-pyrazol-4-yl)acetamide
CID 83815139
9-imidazol-1-yl-N-methylnonanamide
CID 12803322
N-(2-amino-5-chlorophenyl)-4-imidazol-1-ylbutanamide
CID 16788832
(E)-but-2-enedioic acid;N-(2,6-dimethylphenyl)-4-imidazol-1-ylbutanamide
CID 131715267

Frequently Asked Questions

What is the IUPAC name of 4-imidazol-1-yl-N-(1H-pyrazol-4-yl)butanamide?
The IUPAC name of 4-imidazol-1-yl-N-(1H-pyrazol-4-yl)butanamide (CID 166195192) is 4-imidazol-1-yl-N-(1H-pyrazol-4-yl)butanamide.
What is the SMILES notation for 4-imidazol-1-yl-N-(1H-pyrazol-4-yl)butanamide?
The canonical SMILES for 4-imidazol-1-yl-N-(1H-pyrazol-4-yl)butanamide is O=C(CCCn1ccnc1)Nc1cn[nH]c1.
What is the InChIKey of 4-imidazol-1-yl-N-(1H-pyrazol-4-yl)butanamide?
The InChIKey is VDFSNQIWQAOPHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c16-10(14-9-6-12-13-7-9)2-1-4-15-5-3-11-8-15/h3,5-8H,1-2,4H2,(H,12,13)(H,14,16).
What are the key properties of 4-imidazol-1-yl-N-(1H-pyrazol-4-yl)butanamide?
4-imidazol-1-yl-N-(1H-pyrazol-4-yl)butanamide has a molecular weight of 219.25 g/mol, XLogP of 1.03, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imidazol-1-yl-N-(1H-pyrazol-4-yl)butanamide is sourced from PubChem (CID 166195192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).