N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide

C18H18N8O — CID 90651651

IUPACN-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide
SMILESCCC(NC(=O)Cn1nnc(-c2ccccc2)n1)c1cn2cccnc2n1
InChIInChI=1S/C18H18N8O/c1-2-14(15-11-25-10-6-9-19-18(25)21-15)20-16(27)12-26-23-17(22-24-26)13-7-4-3-5-8-13/h3-11,14H,2,12H2,1H3,(H,20,27)
InChIKeyXQZWHPDMSBBDMU-UHFFFAOYSA-N
MW362.40 g/mol
LogP1.65
Rot. Bonds6

About N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide

N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide (PubChem CID 90651651) has the molecular formula C18H18N8O and a molecular weight of 362.40 g/mol. Its IUPAC name is N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide.

Molecular Properties

Compound NameN-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide
PubChem CID90651651
Molecular FormulaC18H18N8O
Molecular Weight362.40 g/mol
Exact Mass362.16
IUPAC NameN-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide
SMILESCCC(NC(=O)Cn1nnc(-c2ccccc2)n1)c1cn2cccnc2n1
InChIInChI=1S/C18H18N8O/c1-2-14(15-11-25-10-6-9-19-18(25)21-15)20-16(27)12-26-23-17(22-24-26)13-7-4-3-5-8-13/h3-11,14H,2,12H2,1H3,(H,20,27)
InChIKeyXQZWHPDMSBBDMU-UHFFFAOYSA-N
XLogP1.65
TPSA102.89 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.40
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)acetamide
CID 86285049
N-[(1S)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-(4-oxoquinazolin-3-yl)acetamide
CID 97124356
N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
CID 90651094
N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 86285330
N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-(2,4,7-trimethyl-1H-indol-3-yl)acetamide
CID 97136855
1-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-3-(1-propyltriazol-4-yl)urea
CID 72879096
N-[(1R)-1-(4-methylphenyl)propyl]-2-[5-(4-methylphenyl)tetrazol-2-yl]acetamide
CID 7465586
N-[(1S)-1-(4-methylphenyl)propyl]-2-[5-(4-methylphenyl)tetrazol-2-yl]acetamide
CID 7465585
5-chloro-N-[(1S)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]thiophene-2-carboxamide
CID 99973548
3-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]butanoic acid
CID 119221158
N-[(2R)-3-oxo-1-phenylbutan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 7634196
3-(1,3-benzodioxol-5-yl)-N-[(1S)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]propanamide
CID 99932489

Frequently Asked Questions

What is the IUPAC name of N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide?
The IUPAC name of N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide (CID 90651651) is N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide.
What is the SMILES notation for N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide?
The canonical SMILES for N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide is CCC(NC(=O)Cn1nnc(-c2ccccc2)n1)c1cn2cccnc2n1.
What is the InChIKey of N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide?
The InChIKey is XQZWHPDMSBBDMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N8O/c1-2-14(15-11-25-10-6-9-19-18(25)21-15)20-16(27)12-26-23-17(22-24-26)13-7-4-3-5-8-13/h3-11,14H,2,12H2,1H3,(H,20,27).
What are the key properties of N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide?
N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide has a molecular weight of 362.40 g/mol, XLogP of 1.65, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-imidazo[1,2-a]pyrimidin-2-ylpropyl)-2-(5-phenyltetrazol-2-yl)acetamide is sourced from PubChem (CID 90651651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).