N-[1-(5-methyl-1H-imidazol-2-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide

C14H21N5O — CID 131930615

IUPACN-[1-(5-methyl-1H-imidazol-2-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide
SMILESCCC(NC(=O)CCn1nccc1C)c1ncc(C)[nH]1
InChIInChI=1S/C14H21N5O/c1-4-12(14-15-9-10(2)17-14)18-13(20)6-8-19-11(3)5-7-16-19/h5,7,9,12H,4,6,8H2,1-3H3,(H,15,17)(H,18,20)
InChIKeyZHBVDSGDSSTCKG-UHFFFAOYSA-N
MW275.36 g/mol
LogP1.88
Rot. Bonds6

About N-[1-(5-methyl-1H-imidazol-2-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide

N-[1-(5-methyl-1H-imidazol-2-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide (PubChem CID 131930615) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is N-[1-(5-methyl-1H-imidazol-2-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide.

Molecular Properties

Compound NameN-[1-(5-methyl-1H-imidazol-2-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide
PubChem CID131930615
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC NameN-[1-(5-methyl-1H-imidazol-2-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide
SMILESCCC(NC(=O)CCn1nccc1C)c1ncc(C)[nH]1
InChIInChI=1S/C14H21N5O/c1-4-12(14-15-9-10(2)17-14)18-13(20)6-8-19-11(3)5-7-16-19/h5,7,9,12H,4,6,8H2,1-3H3,(H,15,17)(H,18,20)
InChIKeyZHBVDSGDSSTCKG-UHFFFAOYSA-N
XLogP1.88
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methyl-1H-imidazol-2-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide?
The IUPAC name of N-[1-(5-methyl-1H-imidazol-2-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide (CID 131930615) is N-[1-(5-methyl-1H-imidazol-2-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide.
What is the SMILES notation for N-[1-(5-methyl-1H-imidazol-2-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide?
The canonical SMILES for N-[1-(5-methyl-1H-imidazol-2-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide is CCC(NC(=O)CCn1nccc1C)c1ncc(C)[nH]1.
What is the InChIKey of N-[1-(5-methyl-1H-imidazol-2-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide?
The InChIKey is ZHBVDSGDSSTCKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-4-12(14-15-9-10(2)17-14)18-13(20)6-8-19-11(3)5-7-16-19/h5,7,9,12H,4,6,8H2,1-3H3,(H,15,17)(H,18,20).
What are the key properties of N-[1-(5-methyl-1H-imidazol-2-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide?
N-[1-(5-methyl-1H-imidazol-2-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide has a molecular weight of 275.36 g/mol, XLogP of 1.88, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methyl-1H-imidazol-2-yl)propyl]-3-(5-methylpyrazol-1-yl)propanamide is sourced from PubChem (CID 131930615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).