N-methyl-1-[2-(3-methylcyclopentyl)-4-propylpyrimidin-5-yl]methanamine

C15H25N3 — CID 114206597

IUPACN-methyl-1-[2-(3-methylcyclopentyl)-4-propylpyrimidin-5-yl]methanamine
SMILESCCCc1nc(C2CCC(C)C2)ncc1CNC
InChIInChI=1S/C15H25N3/c1-4-5-14-13(9-16-3)10-17-15(18-14)12-7-6-11(2)8-12/h10-12,16H,4-9H2,1-3H3
InChIKeyREXLHLZYIWZRQE-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.05
Rot. Bonds5

About N-methyl-1-[2-(3-methylcyclopentyl)-4-propylpyrimidin-5-yl]methanamine

N-methyl-1-[2-(3-methylcyclopentyl)-4-propylpyrimidin-5-yl]methanamine (PubChem CID 114206597) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is N-methyl-1-[2-(3-methylcyclopentyl)-4-propylpyrimidin-5-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(3-methylcyclopentyl)-4-propylpyrimidin-5-yl]methanamine
PubChem CID114206597
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC NameN-methyl-1-[2-(3-methylcyclopentyl)-4-propylpyrimidin-5-yl]methanamine
SMILESCCCc1nc(C2CCC(C)C2)ncc1CNC
InChIInChI=1S/C15H25N3/c1-4-5-14-13(9-16-3)10-17-15(18-14)12-7-6-11(2)8-12/h10-12,16H,4-9H2,1-3H3
InChIKeyREXLHLZYIWZRQE-UHFFFAOYSA-N
XLogP3.05
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(3-methylcyclohexyl)-4-propylpyrimidin-5-yl]methanol
CID 114205023
N-methyl-1-[2-(3-methylcyclopentyl)pyrimidin-5-yl]methanamine
CID 65412821
N-ethyl-1-[4-methyl-2-(3-methylcyclopentyl)pyrimidin-5-yl]ethanamine
CID 65414648
5-bromo-N-ethyl-2-(3-methylcyclopentyl)-6-propylpyrimidin-4-amine
CID 66305161
N-methyl-1-(2-piperidin-1-yl-4-propylpyrimidin-5-yl)methanamine
CID 114206595
2-[2-(3-methylcyclopentyl)pyrimidin-5-yl]ethanamine
CID 65415056
5-methyl-2-(3-methylcyclopentyl)pyrimidin-4-amine
CID 130494284
4-chloro-5-iodo-2-(3-methylcyclopentyl)-6-propylpyrimidine
CID 66295009
5-(chloromethyl)-2-(3-methylcyclopentyl)pyrimidine
CID 65413433
2-(3-methylcyclopentyl)-N-propyl-5,6,7,8-tetrahydroquinazolin-5-amine
CID 65414221
N-[[4-ethyl-2-(oxolan-3-yl)pyrimidin-5-yl]methyl]propan-1-amine
CID 114206721
1-(2-cyclopropylpyrimidin-5-yl)-N-methylmethanamine
CID 62756946

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(3-methylcyclopentyl)-4-propylpyrimidin-5-yl]methanamine?
The IUPAC name of N-methyl-1-[2-(3-methylcyclopentyl)-4-propylpyrimidin-5-yl]methanamine (CID 114206597) is N-methyl-1-[2-(3-methylcyclopentyl)-4-propylpyrimidin-5-yl]methanamine.
What is the SMILES notation for N-methyl-1-[2-(3-methylcyclopentyl)-4-propylpyrimidin-5-yl]methanamine?
The canonical SMILES for N-methyl-1-[2-(3-methylcyclopentyl)-4-propylpyrimidin-5-yl]methanamine is CCCc1nc(C2CCC(C)C2)ncc1CNC.
What is the InChIKey of N-methyl-1-[2-(3-methylcyclopentyl)-4-propylpyrimidin-5-yl]methanamine?
The InChIKey is REXLHLZYIWZRQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-4-5-14-13(9-16-3)10-17-15(18-14)12-7-6-11(2)8-12/h10-12,16H,4-9H2,1-3H3.
What are the key properties of N-methyl-1-[2-(3-methylcyclopentyl)-4-propylpyrimidin-5-yl]methanamine?
N-methyl-1-[2-(3-methylcyclopentyl)-4-propylpyrimidin-5-yl]methanamine has a molecular weight of 247.39 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(3-methylcyclopentyl)-4-propylpyrimidin-5-yl]methanamine is sourced from PubChem (CID 114206597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).