2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylbutan-1-ol

C16H21N3O — CID 63027144

IUPAC2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylbutan-1-ol
SMILESCCC(C(O)c1ccccc1)N1CCn2ccnc2C1
InChIInChI=1S/C16H21N3O/c1-2-14(16(20)13-6-4-3-5-7-13)19-11-10-18-9-8-17-15(18)12-19/h3-9,14,16,20H,2,10-12H2,1H3
InChIKeyAGUPHHSRFAKXTE-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.21
Rot. Bonds4

About 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylbutan-1-ol

2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylbutan-1-ol (PubChem CID 63027144) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylbutan-1-ol.

Molecular Properties

Compound Name2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylbutan-1-ol
PubChem CID63027144
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylbutan-1-ol
SMILESCCC(C(O)c1ccccc1)N1CCn2ccnc2C1
InChIInChI=1S/C16H21N3O/c1-2-14(16(20)13-6-4-3-5-7-13)19-11-10-18-9-8-17-15(18)12-19/h3-9,14,16,20H,2,10-12H2,1H3
InChIKeyAGUPHHSRFAKXTE-UHFFFAOYSA-N
XLogP2.21
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-phenylethyl]propan-1-amine
CID 63026877
1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-pyridin-4-ylbutan-2-amine
CID 63015120
1-phenyl-2-(4-propan-2-ylpiperidin-1-yl)butan-1-ol
CID 103501712
1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(4-methylphenyl)butan-2-amine
CID 63014225
2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-methylpentan-3-amine
CID 63015349
N-[2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylethyl]propan-1-amine
CID 63014273
3-amino-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-5-methylhexan-1-ol
CID 114357196
2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)propan-1-amine
CID 63015141
2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-methyl-N-(2-methylpropyl)butan-1-amine
CID 55144039
1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-pyridin-3-ylpropan-2-amine
CID 55150516
3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(2-fluorophenyl)-2-methylpropan-1-ol
CID 115997149
4-[2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)propyl]phenol
CID 82979541

Frequently Asked Questions

What is the IUPAC name of 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylbutan-1-ol?
The IUPAC name of 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylbutan-1-ol (CID 63027144) is 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylbutan-1-ol.
What is the SMILES notation for 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylbutan-1-ol?
The canonical SMILES for 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylbutan-1-ol is CCC(C(O)c1ccccc1)N1CCn2ccnc2C1.
What is the InChIKey of 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylbutan-1-ol?
The InChIKey is AGUPHHSRFAKXTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-2-14(16(20)13-6-4-3-5-7-13)19-11-10-18-9-8-17-15(18)12-19/h3-9,14,16,20H,2,10-12H2,1H3.
What are the key properties of 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylbutan-1-ol?
2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylbutan-1-ol has a molecular weight of 271.36 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylbutan-1-ol is sourced from PubChem (CID 63027144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).