(4R)-8-(7-methyl-8-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-yl)-8-azaspiro[4.5]decan-4-amine

C21H26N6 — CID 146466944

IUPAC(4R)-8-(7-methyl-8-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-yl)-8-azaspiro[4.5]decan-4-amine
SMILESCc1nc(N2CCC3(CCC[C@H]3N)CC2)n2ccnc2c1-c1ccncc1
InChIInChI=1S/C21H26N6/c1-15-18(16-4-9-23-10-5-16)19-24-11-14-27(19)20(25-15)26-12-7-21(8-13-26)6-2-3-17(21)22/h4-5,9-11,14,17H,2-3,6-8,12-13,22H2,1H3/t17-/m1/s1
InChIKeyCBFBQDJHYITIJX-QGZVFWFLSA-N
MW362.48 g/mol
LogP3.20
Rot. Bonds2

About (4R)-8-(7-methyl-8-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-yl)-8-azaspiro[4.5]decan-4-amine

(4R)-8-(7-methyl-8-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-yl)-8-azaspiro[4.5]decan-4-amine (PubChem CID 146466944) has the molecular formula C21H26N6 and a molecular weight of 362.48 g/mol. Its IUPAC name is (4R)-8-(7-methyl-8-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-yl)-8-azaspiro[4.5]decan-4-amine.

Molecular Properties

Compound Name(4R)-8-(7-methyl-8-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-yl)-8-azaspiro[4.5]decan-4-amine
PubChem CID146466944
Molecular FormulaC21H26N6
Molecular Weight362.48 g/mol
Exact Mass362.22
IUPAC Name(4R)-8-(7-methyl-8-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-yl)-8-azaspiro[4.5]decan-4-amine
SMILESCc1nc(N2CCC3(CCC[C@H]3N)CC2)n2ccnc2c1-c1ccncc1
InChIInChI=1S/C21H26N6/c1-15-18(16-4-9-23-10-5-16)19-24-11-14-27(19)20(25-15)26-12-7-21(8-13-26)6-2-3-17(21)22/h4-5,9-11,14,17H,2-3,6-8,12-13,22H2,1H3/t17-/m1/s1
InChIKeyCBFBQDJHYITIJX-QGZVFWFLSA-N
XLogP3.20
TPSA72.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.48
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (4R)-8-(7-methyl-8-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-yl)-8-azaspiro[4.5]decan-4-amine?
The IUPAC name of (4R)-8-(7-methyl-8-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-yl)-8-azaspiro[4.5]decan-4-amine (CID 146466944) is (4R)-8-(7-methyl-8-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-yl)-8-azaspiro[4.5]decan-4-amine.
What is the SMILES notation for (4R)-8-(7-methyl-8-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-yl)-8-azaspiro[4.5]decan-4-amine?
The canonical SMILES for (4R)-8-(7-methyl-8-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-yl)-8-azaspiro[4.5]decan-4-amine is Cc1nc(N2CCC3(CCC[C@H]3N)CC2)n2ccnc2c1-c1ccncc1.
What is the InChIKey of (4R)-8-(7-methyl-8-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-yl)-8-azaspiro[4.5]decan-4-amine?
The InChIKey is CBFBQDJHYITIJX-QGZVFWFLSA-N. The full InChI is InChI=1S/C21H26N6/c1-15-18(16-4-9-23-10-5-16)19-24-11-14-27(19)20(25-15)26-12-7-21(8-13-26)6-2-3-17(21)22/h4-5,9-11,14,17H,2-3,6-8,12-13,22H2,1H3/t17-/m1/s1.
What are the key properties of (4R)-8-(7-methyl-8-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-yl)-8-azaspiro[4.5]decan-4-amine?
(4R)-8-(7-methyl-8-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-yl)-8-azaspiro[4.5]decan-4-amine has a molecular weight of 362.48 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-8-(7-methyl-8-pyridin-4-ylimidazo[1,2-c]pyrimidin-5-yl)-8-azaspiro[4.5]decan-4-amine is sourced from PubChem (CID 146466944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).