4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine

C15H25N5O — CID 146044412

IUPAC4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine
SMILESCOc1cc(N2CCC(C3CCNCC3)CC2)nc(N)n1
InChIInChI=1S/C15H25N5O/c1-21-14-10-13(18-15(16)19-14)20-8-4-12(5-9-20)11-2-6-17-7-3-11/h10-12,17H,2-9H2,1H3,(H2,16,18,19)
InChIKeyWTSMZGGWFVXWBC-UHFFFAOYSA-N
MW291.40 g/mol
LogP1.28
Rot. Bonds3

About 4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine

4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine (PubChem CID 146044412) has the molecular formula C15H25N5O and a molecular weight of 291.40 g/mol. Its IUPAC name is 4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine
PubChem CID146044412
Molecular FormulaC15H25N5O
Molecular Weight291.40 g/mol
Exact Mass291.21
IUPAC Name4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine
SMILESCOc1cc(N2CCC(C3CCNCC3)CC2)nc(N)n1
InChIInChI=1S/C15H25N5O/c1-21-14-10-13(18-15(16)19-14)20-8-4-12(5-9-20)11-2-6-17-7-3-11/h10-12,17H,2-9H2,1H3,(H2,16,18,19)
InChIKeyWTSMZGGWFVXWBC-UHFFFAOYSA-N
XLogP1.28
TPSA76.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-methoxy-6-[4-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-4-yl]piperidin-1-yl]pyrimidin-2-amine
CID 155498675
4-[4-(imidazol-1-ylmethyl)piperidin-1-yl]-6-methoxypyrimidin-2-amine
CID 45250223
2-[4-(2-amino-6-methoxypyrimidin-4-yl)piperazin-1-yl]ethanol
CID 113268082
4-[3-(dimethylamino)piperidin-1-yl]-6-methoxypyrimidin-2-amine
CID 45184702
4-[4-(6-fluoro-1H-benzimidazol-2-yl)piperidin-1-yl]-6-methoxypyrimidin-2-amine
CID 72846151
4-[(3R)-3-(2-fluorophenyl)pyrrolidin-1-yl]-6-methoxypyrimidin-2-amine
CID 97282747
4-[(3S)-3-(2-fluorophenyl)pyrrolidin-1-yl]-6-methoxypyrimidin-2-amine
CID 97282748
6-piperazin-1-ylpyrimidine-2,4-diamine
CID 21363888
N-[[1-(2-amino-6-methoxypyrimidin-4-yl)piperidin-4-yl]methyl]-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 131942655
6-(4-methylpiperazin-1-yl)-4-N-piperidin-4-ylpyrimidine-2,4-diamine
CID 68551068
4-methyl-6-[4-[1-(5-methylpyrimidin-2-yl)piperidin-4-yl]piperidin-1-yl]pyrimidin-2-amine
CID 71081298
[1-(2-amino-6-methoxypyrimidin-4-yl)piperidin-4-yl]-[(3S)-3-phenyl-3,4-dihydropyrazol-2-yl]methanone
CID 134521427

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine?
The IUPAC name of 4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine (CID 146044412) is 4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine.
What is the SMILES notation for 4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine?
The canonical SMILES for 4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine is COc1cc(N2CCC(C3CCNCC3)CC2)nc(N)n1.
What is the InChIKey of 4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine?
The InChIKey is WTSMZGGWFVXWBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O/c1-21-14-10-13(18-15(16)19-14)20-8-4-12(5-9-20)11-2-6-17-7-3-11/h10-12,17H,2-9H2,1H3,(H2,16,18,19).
What are the key properties of 4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine?
4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine has a molecular weight of 291.40 g/mol, XLogP of 1.28, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine is sourced from PubChem (CID 146044412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).