N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine

C19H23N7 — CID 95862840

IUPACN-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCC[C@@H](Nc1cc(C(C)C)nc2cc(C)nn12)c1cn2cccnc2n1
InChIInChI=1S/C19H23N7/c1-5-14(16-11-25-8-6-7-20-19(25)23-16)21-18-10-15(12(2)3)22-17-9-13(4)24-26(17)18/h6-12,14,21H,5H2,1-4H3/t14-/m1/s1
InChIKeyNUDZGMCFNKYOKN-CQSZACIVSA-N
MW349.44 g/mol
LogP3.77
Rot. Bonds5

About N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine

N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 95862840) has the molecular formula C19H23N7 and a molecular weight of 349.44 g/mol. Its IUPAC name is N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound NameN-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID95862840
Molecular FormulaC19H23N7
Molecular Weight349.44 g/mol
Exact Mass349.20
IUPAC NameN-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCC[C@@H](Nc1cc(C(C)C)nc2cc(C)nn12)c1cn2cccnc2n1
InChIInChI=1S/C19H23N7/c1-5-14(16-11-25-8-6-7-20-19(25)23-16)21-18-10-15(12(2)3)22-17-9-13(4)24-26(17)18/h6-12,14,21H,5H2,1-4H3/t14-/m1/s1
InChIKeyNUDZGMCFNKYOKN-CQSZACIVSA-N
XLogP3.77
TPSA72.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine (CID 95862840) is N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine is CC[C@@H](Nc1cc(C(C)C)nc2cc(C)nn12)c1cn2cccnc2n1.
What is the InChIKey of N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is NUDZGMCFNKYOKN-CQSZACIVSA-N. The full InChI is InChI=1S/C19H23N7/c1-5-14(16-11-25-8-6-7-20-19(25)23-16)21-18-10-15(12(2)3)22-17-9-13(4)24-26(17)18/h6-12,14,21H,5H2,1-4H3/t14-/m1/s1.
What are the key properties of N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine?
N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 349.44 g/mol, XLogP of 3.77, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-imidazo[1,2-a]pyrimidin-2-ylpropyl]-2-methyl-5-propan-2-ylpyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 95862840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).