N-(6,7-dihydro-5H-cyclopenta[b]pyrazin-6-yl)-3-phenylpropanamide

C16H17N3O — CID 167947656

IUPACN-(6,7-dihydro-5H-cyclopenta[b]pyrazin-6-yl)-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NC1Cc2nccnc2C1
InChIInChI=1S/C16H17N3O/c20-16(7-6-12-4-2-1-3-5-12)19-13-10-14-15(11-13)18-9-8-17-14/h1-5,8-9,13H,6-7,10-11H2,(H,19,20)
InChIKeyDYGUSDLJIZMJGR-UHFFFAOYSA-N
MW267.33 g/mol
LogP1.69
Rot. Bonds4

About N-(6,7-dihydro-5H-cyclopenta[b]pyrazin-6-yl)-3-phenylpropanamide

N-(6,7-dihydro-5H-cyclopenta[b]pyrazin-6-yl)-3-phenylpropanamide (PubChem CID 167947656) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is N-(6,7-dihydro-5H-cyclopenta[b]pyrazin-6-yl)-3-phenylpropanamide.

Molecular Properties

Compound NameN-(6,7-dihydro-5H-cyclopenta[b]pyrazin-6-yl)-3-phenylpropanamide
PubChem CID167947656
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC NameN-(6,7-dihydro-5H-cyclopenta[b]pyrazin-6-yl)-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NC1Cc2nccnc2C1
InChIInChI=1S/C16H17N3O/c20-16(7-6-12-4-2-1-3-5-12)19-13-10-14-15(11-13)18-9-8-17-14/h1-5,8-9,13H,6-7,10-11H2,(H,19,20)
InChIKeyDYGUSDLJIZMJGR-UHFFFAOYSA-N
XLogP1.69
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylcyclohexyl)-3-phenylpropanamide
CID 78786023
3-phenyl-N-piperidin-4-ylpropanamide
CID 16795625
N-[4-(bromomethyl)cyclohexyl]-3-phenylpropanamide
CID 112752998
N-(1-benzoylpiperidin-4-yl)-3-phenylpropanamide
CID 46464328
N-(1-benzylpiperidin-3-yl)-3-phenylpropanamide
CID 42958724
N-(3-azabicyclo[3.1.0]hexan-6-yl)-3-phenylpropanamide
CID 43594407
N-(1-tert-butyl-5-oxopyrrolidin-3-yl)-3-phenylpropanamide
CID 110736896
N-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-3-phenylpropanamide
CID 10858934
N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]-3-phenylpropanamide
CID 91626381
N-[4-(4,6-dimethylpyrimidin-2-yl)oxycyclohexyl]-3-phenylpropanamide
CID 90634754
N-[(4S)-2-oxoazepan-4-yl]-4-phenylbutanamide
CID 18648130
N-(1-ethylsulfonylpiperidin-4-yl)-3-phenylpropanamide
CID 33220250

Frequently Asked Questions

What is the IUPAC name of N-(6,7-dihydro-5H-cyclopenta[b]pyrazin-6-yl)-3-phenylpropanamide?
The IUPAC name of N-(6,7-dihydro-5H-cyclopenta[b]pyrazin-6-yl)-3-phenylpropanamide (CID 167947656) is N-(6,7-dihydro-5H-cyclopenta[b]pyrazin-6-yl)-3-phenylpropanamide.
What is the SMILES notation for N-(6,7-dihydro-5H-cyclopenta[b]pyrazin-6-yl)-3-phenylpropanamide?
The canonical SMILES for N-(6,7-dihydro-5H-cyclopenta[b]pyrazin-6-yl)-3-phenylpropanamide is O=C(CCc1ccccc1)NC1Cc2nccnc2C1.
What is the InChIKey of N-(6,7-dihydro-5H-cyclopenta[b]pyrazin-6-yl)-3-phenylpropanamide?
The InChIKey is DYGUSDLJIZMJGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c20-16(7-6-12-4-2-1-3-5-12)19-13-10-14-15(11-13)18-9-8-17-14/h1-5,8-9,13H,6-7,10-11H2,(H,19,20).
What are the key properties of N-(6,7-dihydro-5H-cyclopenta[b]pyrazin-6-yl)-3-phenylpropanamide?
N-(6,7-dihydro-5H-cyclopenta[b]pyrazin-6-yl)-3-phenylpropanamide has a molecular weight of 267.33 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6,7-dihydro-5H-cyclopenta[b]pyrazin-6-yl)-3-phenylpropanamide is sourced from PubChem (CID 167947656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).