N-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide

C17H17N5O — CID 95147611

IUPACN-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide
SMILESCC(=O)N[C@H](C)c1ccc(-n2ccc(-c3cnccn3)n2)cc1
InChIInChI=1S/C17H17N5O/c1-12(20-13(2)23)14-3-5-15(6-4-14)22-10-7-16(21-22)17-11-18-8-9-19-17/h3-12H,1-2H3,(H,20,23)/t12-/m1/s1
InChIKeyLTSCSJOYNFOMTR-GFCCVEGCSA-N
MW307.36 g/mol
LogP2.53
Rot. Bonds4

About N-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide

N-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide (PubChem CID 95147611) has the molecular formula C17H17N5O and a molecular weight of 307.36 g/mol. Its IUPAC name is N-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide.

Molecular Properties

Compound NameN-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide
PubChem CID95147611
Molecular FormulaC17H17N5O
Molecular Weight307.36 g/mol
Exact Mass307.14
IUPAC NameN-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide
SMILESCC(=O)N[C@H](C)c1ccc(-n2ccc(-c3cnccn3)n2)cc1
InChIInChI=1S/C17H17N5O/c1-12(20-13(2)23)14-3-5-15(6-4-14)22-10-7-16(21-22)17-11-18-8-9-19-17/h3-12H,1-2H3,(H,20,23)/t12-/m1/s1
InChIKeyLTSCSJOYNFOMTR-GFCCVEGCSA-N
XLogP2.53
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.36
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(1R)-1-[4-(2-pyridin-2-ylimidazol-1-yl)phenyl]ethyl]acetamide
CID 95120692
N-[(1S)-1-[4-[4-(2-hydroxyethyl)pyrazol-1-yl]phenyl]ethyl]acetamide
CID 95121862
1,3-bis[1-(4-imidazol-1-ylphenyl)ethyl]urea
CID 174999274
N-[(1S)-1-(6-methyl-3-pyridinyl)ethyl]acetamide
CID 100987523
N-[(1S)-1-pyridin-4-ylethyl]pyrazine-2-carboxamide
CID 30479888
N-[1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]acetamide
CID 68813957
N-[1-(3-imidazol-1-ylphenyl)ethyl]acetamide
CID 175743937
3-chloro-N-[(1S)-1-[4-(triazol-1-yl)phenyl]ethyl]pyridine-4-carboxamide
CID 97244358
N-[1-(3-pyrazol-1-ylphenyl)ethyl]acetamide
CID 175743985
1-[1-(4-imidazol-1-ylphenyl)ethyl]-3-pyridin-3-ylurea
CID 18129096
N-[(1R)-1-[4-[(2S)-2-chloropropanoyl]phenyl]ethyl]acetamide
CID 124500379
N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]quinoxaline-2-carboxamide
CID 41082957

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide?
The IUPAC name of N-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide (CID 95147611) is N-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide.
What is the SMILES notation for N-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide?
The canonical SMILES for N-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide is CC(=O)N[C@H](C)c1ccc(-n2ccc(-c3cnccn3)n2)cc1.
What is the InChIKey of N-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide?
The InChIKey is LTSCSJOYNFOMTR-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H17N5O/c1-12(20-13(2)23)14-3-5-15(6-4-14)22-10-7-16(21-22)17-11-18-8-9-19-17/h3-12H,1-2H3,(H,20,23)/t12-/m1/s1.
What are the key properties of N-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide?
N-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide has a molecular weight of 307.36 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-[4-(3-pyrazin-2-ylpyrazol-1-yl)phenyl]ethyl]acetamide is sourced from PubChem (CID 95147611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).