6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine

C16H28N4O — CID 79703231

IUPAC6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine
SMILESCCOc1cc(N(CC2CCNCC2)C(C)C)nc(C)n1
InChIInChI=1S/C16H28N4O/c1-5-21-16-10-15(18-13(4)19-16)20(12(2)3)11-14-6-8-17-9-7-14/h10,12,14,17H,5-9,11H2,1-4H3
InChIKeyXUMWQZKEJFMBSI-UHFFFAOYSA-N
MW292.43 g/mol
LogP2.40
Rot. Bonds6

About 6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine

6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine (PubChem CID 79703231) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is 6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine
PubChem CID79703231
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC Name6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine
SMILESCCOc1cc(N(CC2CCNCC2)C(C)C)nc(C)n1
InChIInChI=1S/C16H28N4O/c1-5-21-16-10-15(18-13(4)19-16)20(12(2)3)11-14-6-8-17-9-7-14/h10,12,14,17H,5-9,11H2,1-4H3
InChIKeyXUMWQZKEJFMBSI-UHFFFAOYSA-N
XLogP2.40
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine 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

6-ethoxy-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyridin-2-amine
CID 79719565
methyl 2-[(6-ethoxy-2-methylpyrimidin-4-yl)-propan-2-ylamino]acetate
CID 66331702
4-ethoxy-N,6-dimethyl-N-(piperidin-4-ylmethyl)pyrimidin-2-amine
CID 112635056
6-ethoxy-2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
CID 106620544
4-N-(cyclopropylmethyl)-6-N,2-dimethyl-4-N-propan-2-ylpyrimidine-4,6-diamine
CID 80821545
5-methoxy-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyridin-2-amine
CID 106504475
4-ethoxy-6-methyl-N-(piperidin-4-ylmethyl)-N-propylpyrimidin-2-amine
CID 115973542
N,6-diethyl-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine
CID 79720099
N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine
CID 79720132
N-(cyclopropylmethyl)-6-hydrazinyl-2-methyl-N-propan-2-ylpyrimidin-4-amine
CID 80905091
N-(piperidin-4-ylmethyl)-N-propan-2-ylquinoxalin-2-amine
CID 79705201
6-[piperidin-4-ylmethyl(propan-2-yl)amino]pyridine-3-carbonitrile
CID 79719998

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine (CID 79703231) is 6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine is CCOc1cc(N(CC2CCNCC2)C(C)C)nc(C)n1.
What is the InChIKey of 6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine?
The InChIKey is XUMWQZKEJFMBSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-5-21-16-10-15(18-13(4)19-16)20(12(2)3)11-14-6-8-17-9-7-14/h10,12,14,17H,5-9,11H2,1-4H3.
What are the key properties of 6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine?
6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine has a molecular weight of 292.43 g/mol, XLogP of 2.40, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-2-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 79703231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).