6-(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-N-phenylpyrimidin-4-amine

C19H25N5 — CID 154865703

IUPAC6-(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-N-phenylpyrimidin-4-amine
SMILESCN1CCCC12CCN(c1cc(Nc3ccccc3)ncn1)CC2
InChIInChI=1S/C19H25N5/c1-23-11-5-8-19(23)9-12-24(13-10-19)18-14-17(20-15-21-18)22-16-6-3-2-4-7-16/h2-4,6-7,14-15H,5,8-13H2,1H3,(H,20,21,22)
InChIKeyWSIXPBHWJAGGOH-UHFFFAOYSA-N
MW323.44 g/mol
LogP3.28
Rot. Bonds3

About 6-(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-N-phenylpyrimidin-4-amine

6-(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-N-phenylpyrimidin-4-amine (PubChem CID 154865703) has the molecular formula C19H25N5 and a molecular weight of 323.44 g/mol. Its IUPAC name is 6-(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-N-phenylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-N-phenylpyrimidin-4-amine
PubChem CID154865703
Molecular FormulaC19H25N5
Molecular Weight323.44 g/mol
Exact Mass323.21
IUPAC Name6-(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-N-phenylpyrimidin-4-amine
SMILESCN1CCCC12CCN(c1cc(Nc3ccccc3)ncn1)CC2
InChIInChI=1S/C19H25N5/c1-23-11-5-8-19(23)9-12-24(13-10-19)18-14-17(20-15-21-18)22-16-6-3-2-4-7-16/h2-4,6-7,14-15H,5,8-13H2,1H3,(H,20,21,22)
InChIKeyWSIXPBHWJAGGOH-UHFFFAOYSA-N
XLogP3.28
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-N-phenyl-4-N-(6-pyrrolidin-1-ylpyrimidin-4-yl)benzene-1,4-diamine
CID 122282330
N-phenyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidin-4-amine
CID 112863373
N-(4-methylphenyl)-6-(4-phenylpiperazin-1-yl)pyrimidin-4-amine
CID 112862245
1,3-dimethyl-5-[(6-pyrrolidin-1-ylpyrimidin-4-yl)amino]benzimidazol-2-one
CID 22433058
4-N,4-N-dimethyl-1-N-(6-pyrrolidin-1-ylpyrimidin-4-yl)benzene-1,4-diamine
CID 112855770
N-(4-ethoxyphenyl)-6-(4-phenylpiperazin-1-yl)pyrimidin-4-amine
CID 112862274
N-(4-ethylphenyl)-6-(4-methylpiperazin-1-yl)pyrimidin-4-amine
CID 99968384
N-(3-bromophenyl)-6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)pyrimidin-4-amine
CID 112862737
N-[3-[[6-(azepan-1-yl)pyrimidin-4-yl]amino]phenyl]acetamide
CID 112864653
N-(4-ethylphenyl)-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-amine
CID 112863306
3-[[6-(azepan-1-yl)pyrimidin-4-yl]amino]benzonitrile
CID 112864690
N-(4-chloro-3-methylphenyl)-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 122282462

Frequently Asked Questions

What is the IUPAC name of 6-(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-N-phenylpyrimidin-4-amine?
The IUPAC name of 6-(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-N-phenylpyrimidin-4-amine (CID 154865703) is 6-(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-N-phenylpyrimidin-4-amine.
What is the SMILES notation for 6-(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-N-phenylpyrimidin-4-amine?
The canonical SMILES for 6-(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-N-phenylpyrimidin-4-amine is CN1CCCC12CCN(c1cc(Nc3ccccc3)ncn1)CC2.
What is the InChIKey of 6-(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-N-phenylpyrimidin-4-amine?
The InChIKey is WSIXPBHWJAGGOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5/c1-23-11-5-8-19(23)9-12-24(13-10-19)18-14-17(20-15-21-18)22-16-6-3-2-4-7-16/h2-4,6-7,14-15H,5,8-13H2,1H3,(H,20,21,22).
What are the key properties of 6-(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-N-phenylpyrimidin-4-amine?
6-(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-N-phenylpyrimidin-4-amine has a molecular weight of 323.44 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methyl-1,8-diazaspiro[4.5]decan-8-yl)-N-phenylpyrimidin-4-amine is sourced from PubChem (CID 154865703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).