1-(5-methoxypyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine

C12H20N4O — CID 114601002

IUPAC1-(5-methoxypyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine
SMILESCNC1(C)CCN(c2ncc(OC)cn2)CC1
InChIInChI=1S/C12H20N4O/c1-12(13-2)4-6-16(7-5-12)11-14-8-10(17-3)9-15-11/h8-9,13H,4-7H2,1-3H3
InChIKeyMRNJUKLSTJSTFW-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.06
Rot. Bonds3

About 1-(5-methoxypyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine

1-(5-methoxypyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine (PubChem CID 114601002) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 1-(5-methoxypyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-(5-methoxypyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine
PubChem CID114601002
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name1-(5-methoxypyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine
SMILESCNC1(C)CCN(c2ncc(OC)cn2)CC1
InChIInChI=1S/C12H20N4O/c1-12(13-2)4-6-16(7-5-12)11-14-8-10(17-3)9-15-11/h8-9,13H,4-7H2,1-3H3
InChIKeyMRNJUKLSTJSTFW-UHFFFAOYSA-N
XLogP1.06
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(azetidin-1-yl)-5-methoxypyrimidine
CID 163343627
9-(5-methoxypyrimidin-2-yl)-4-methyl-1-oxa-4,9-diazaspiro[5.5]undecane
CID 138382150
1-(4,6-dimethylpyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine
CID 113283149
1-(5-methoxypyrimidin-2-yl)azetidin-3-ol
CID 118346552
2-[1-(5-methoxypyrimidin-2-yl)piperidin-4-yl]propan-2-ol
CID 172899246
1-(5-bromopyrimidin-2-yl)-4-(3,5-dimethoxyphenyl)piperidin-4-ol
CID 133362597
1-(5-methoxypyrimidin-2-yl)piperidine-4-carboxamide
CID 154883318
[2-[4-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]piperidin-1-yl]pyrimidin-5-yl]oxyboronic acid
CID 142754886
6-[4-(5-methoxypyrimidin-2-yl)piperazin-1-yl]-[1,2,4]triazolo[4,3-b]pyridazine
CID 171702464
1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N,4-dimethylpiperidin-4-amine
CID 115304899
N,4-dimethyl-1-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)piperidin-4-amine
CID 115305477
1-[1-(5-methoxy-2-pyridinyl)-3-methylpyrrolidin-3-yl]-N-methylmethanamine
CID 106321981

Frequently Asked Questions

What is the IUPAC name of 1-(5-methoxypyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine?
The IUPAC name of 1-(5-methoxypyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine (CID 114601002) is 1-(5-methoxypyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-(5-methoxypyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine?
The canonical SMILES for 1-(5-methoxypyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine is CNC1(C)CCN(c2ncc(OC)cn2)CC1.
What is the InChIKey of 1-(5-methoxypyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine?
The InChIKey is MRNJUKLSTJSTFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-12(13-2)4-6-16(7-5-12)11-14-8-10(17-3)9-15-11/h8-9,13H,4-7H2,1-3H3.
What are the key properties of 1-(5-methoxypyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine?
1-(5-methoxypyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine has a molecular weight of 236.32 g/mol, XLogP of 1.06, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methoxypyrimidin-2-yl)-N,4-dimethylpiperidin-4-amine is sourced from PubChem (CID 114601002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).