N-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine

C15H26N4O — CID 66331952

IUPACN-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine
SMILESCOc1ncnc(N2CCC(CNC(C)C)CC2)c1C
InChIInChI=1S/C15H26N4O/c1-11(2)16-9-13-5-7-19(8-6-13)14-12(3)15(20-4)18-10-17-14/h10-11,13,16H,5-9H2,1-4H3
InChIKeyQNSFTYOIVAGDII-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.01
Rot. Bonds5

About N-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine

N-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine (PubChem CID 66331952) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine
PubChem CID66331952
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine
SMILESCOc1ncnc(N2CCC(CNC(C)C)CC2)c1C
InChIInChI=1S/C15H26N4O/c1-11(2)16-9-13-5-7-19(8-6-13)14-12(3)15(20-4)18-10-17-14/h10-11,13,16H,5-9H2,1-4H3
InChIKeyQNSFTYOIVAGDII-UHFFFAOYSA-N
XLogP2.01
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-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

1-[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]ethanamine
CID 66332963
4-methoxy-5-methyl-6-pyrrolidin-1-ylpyrimidine
CID 130557587
N-[[1-(5-iodopyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine
CID 66319770
1-(6-methoxy-5-methylpyrimidin-4-yl)-N-methylpiperidin-3-amine
CID 66332559
[1-(6-methoxy-5-methylpyrimidin-4-yl)azetidin-3-yl]methanamine
CID 66325530
4-[4-(chloromethyl)piperidin-1-yl]-6-ethoxy-5-methylpyrimidine
CID 66326378
[1-(6-ethoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methanamine
CID 66327389
2-[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-3-yl]acetic acid
CID 66332132
1-(6-methoxy-5-methylpyrimidin-4-yl)-3-propan-2-ylazetidin-3-amine
CID 66325325
[1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidin-2-yl]methanamine
CID 66331951
2-[4-(6-methoxy-5-methylpyrimidin-4-yl)piperazin-1-yl]ethanamine
CID 66331325
N-[(1-pyridin-2-ylpiperidin-4-yl)methyl]propan-2-amine
CID 62592659

Frequently Asked Questions

What is the IUPAC name of N-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine?
The IUPAC name of N-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine (CID 66331952) is N-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine is COc1ncnc(N2CCC(CNC(C)C)CC2)c1C.
What is the InChIKey of N-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine?
The InChIKey is QNSFTYOIVAGDII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-11(2)16-9-13-5-7-19(8-6-13)14-12(3)15(20-4)18-10-17-14/h10-11,13,16H,5-9H2,1-4H3.
What are the key properties of N-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine?
N-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine has a molecular weight of 278.40 g/mol, XLogP of 2.01, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(6-methoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methyl]propan-2-amine is sourced from PubChem (CID 66331952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).