(1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine

C19H24N4 — CID 97400348

IUPAC(1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine
SMILESCN(C)[C@@H]1CC2(CCN(c3ncccn3)CC2)c2ccccc21
InChIInChI=1S/C19H24N4/c1-22(2)17-14-19(16-7-4-3-6-15(16)17)8-12-23(13-9-19)18-20-10-5-11-21-18/h3-7,10-11,17H,8-9,12-14H2,1-2H3/t17-/m1/s1
InChIKeyQOUUJTNXOHVZQR-QGZVFWFLSA-N
MW308.43 g/mol
LogP3.02
Rot. Bonds2

About (1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine

(1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine (PubChem CID 97400348) has the molecular formula C19H24N4 and a molecular weight of 308.43 g/mol. Its IUPAC name is (1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine.

Molecular Properties

Compound Name(1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine
PubChem CID97400348
Molecular FormulaC19H24N4
Molecular Weight308.43 g/mol
Exact Mass308.20
IUPAC Name(1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine
SMILESCN(C)[C@@H]1CC2(CCN(c3ncccn3)CC2)c2ccccc21
InChIInChI=1S/C19H24N4/c1-22(2)17-14-19(16-7-4-3-6-15(16)17)8-12-23(13-9-19)18-20-10-5-11-21-18/h3-7,10-11,17H,8-9,12-14H2,1-2H3/t17-/m1/s1
InChIKeyQOUUJTNXOHVZQR-QGZVFWFLSA-N
XLogP3.02
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine?
The IUPAC name of (1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine (CID 97400348) is (1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine.
What is the SMILES notation for (1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine?
The canonical SMILES for (1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine is CN(C)[C@@H]1CC2(CCN(c3ncccn3)CC2)c2ccccc21.
What is the InChIKey of (1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine?
The InChIKey is QOUUJTNXOHVZQR-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H24N4/c1-22(2)17-14-19(16-7-4-3-6-15(16)17)8-12-23(13-9-19)18-20-10-5-11-21-18/h3-7,10-11,17H,8-9,12-14H2,1-2H3/t17-/m1/s1.
What are the key properties of (1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine?
(1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine has a molecular weight of 308.43 g/mol, XLogP of 3.02, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N,N-dimethyl-1'-pyrimidin-2-ylspiro[1,2-dihydroindene-3,4'-piperidine]-1-amine is sourced from PubChem (CID 97400348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).