1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine

C13H22N4O — CID 66333682

IUPAC1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine
SMILESCOc1cc(N2CCCCC2C(C)N)nc(C)n1
InChIInChI=1S/C13H22N4O/c1-9(14)11-6-4-5-7-17(11)12-8-13(18-3)16-10(2)15-12/h8-9,11H,4-7,14H2,1-3H3
InChIKeyZCVRMMRXCBTFBW-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.50
Rot. Bonds3

About 1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine

1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine (PubChem CID 66333682) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine.

Molecular Properties

Compound Name1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine
PubChem CID66333682
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine
SMILESCOc1cc(N2CCCCC2C(C)N)nc(C)n1
InChIInChI=1S/C13H22N4O/c1-9(14)11-6-4-5-7-17(11)12-8-13(18-3)16-10(2)15-12/h8-9,11H,4-7,14H2,1-3H3
InChIKeyZCVRMMRXCBTFBW-UHFFFAOYSA-N
XLogP1.50
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[2-(chloromethyl)piperidin-1-yl]-6-methoxy-2-methylpyrimidine
CID 66331673
methyl 1-(6-methoxy-2-methylpyrimidin-4-yl)piperidine-2-carboxylate
CID 115538357
1-[1-(6-ethylpyrimidin-4-yl)piperidin-2-yl]ethanamine
CID 63256097
(1R)-1-[(2S)-1-(6-chloro-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanol
CID 129499743
ethyl 1-(6-methoxy-2-methylpyrimidin-4-yl)pyrrolidine-2-carboxylate
CID 66333084
2-methyl-6-(2-propan-2-ylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80855816
1-[1-(5-methylpyrimidin-2-yl)piperidin-2-yl]ethanamine
CID 63255605
1-[1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-2-yl]ethanamine
CID 115973416
6-[2-(1-aminoethyl)piperidin-1-yl]pyridine-2-carbonitrile
CID 64589189
N-[[4-(6-methoxy-2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]propan-2-amine
CID 83105220
1-(6-methoxy-2-methylpyrimidin-4-yl)-2-methylpiperidine-4-carboxylic acid
CID 106742528
1-[1-(6-chloro-2-methylpyrimidin-4-yl)pyrrolidin-2-yl]ethanol
CID 121201735

Frequently Asked Questions

What is the IUPAC name of 1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine?
The IUPAC name of 1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine (CID 66333682) is 1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine.
What is the SMILES notation for 1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine?
The canonical SMILES for 1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine is COc1cc(N2CCCCC2C(C)N)nc(C)n1.
What is the InChIKey of 1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine?
The InChIKey is ZCVRMMRXCBTFBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-9(14)11-6-4-5-7-17(11)12-8-13(18-3)16-10(2)15-12/h8-9,11H,4-7,14H2,1-3H3.
What are the key properties of 1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine?
1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine has a molecular weight of 250.35 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(6-methoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]ethanamine is sourced from PubChem (CID 66333682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).