N-[[2-methyl-4-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-2-amine

C14H24N4 — CID 114215748

IUPACN-[[2-methyl-4-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-2-amine
SMILESCc1ncc(CNC(C)C)c(N2CCCC2C)n1
InChIInChI=1S/C14H24N4/c1-10(2)15-8-13-9-16-12(4)17-14(13)18-7-5-6-11(18)3/h9-11,15H,5-8H2,1-4H3
InChIKeyITCMRXNISVMYBQ-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.27
Rot. Bonds4

About N-[[2-methyl-4-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-2-amine

N-[[2-methyl-4-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-2-amine (PubChem CID 114215748) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[[2-methyl-4-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[2-methyl-4-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-2-amine
PubChem CID114215748
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC NameN-[[2-methyl-4-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-2-amine
SMILESCc1ncc(CNC(C)C)c(N2CCCC2C)n1
InChIInChI=1S/C14H24N4/c1-10(2)15-8-13-9-16-12(4)17-14(13)18-7-5-6-11(18)3/h9-11,15H,5-8H2,1-4H3
InChIKeyITCMRXNISVMYBQ-UHFFFAOYSA-N
XLogP2.27
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[2-(2,5-dimethylpiperidin-1-yl)-4-methylpyrimidin-5-yl]methyl]propan-2-amine
CID 83189393
N-[[6-(2-methylpyrrolidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine
CID 54882321
N-[[5-bromo-2-(2-methylpiperidin-1-yl)-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 62285762
N-[[6-(2-methylpiperidin-1-yl)imidazo[2,1-b][1,3]thiazol-5-yl]methyl]propan-2-amine
CID 43476226
N-methyl-1-[2-methyl-4-(4-methylsulfanylpiperidin-1-yl)pyrimidin-5-yl]methanamine
CID 114238187
N-[(2-methyl-4-pyrrolidin-1-ylpyrimidin-5-yl)methyl]propan-1-amine
CID 114215762
N-[[2-(3-methylmorpholin-4-yl)-3-pyridinyl]methyl]propan-2-amine
CID 62281138
N-[[4-(2-ethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]propan-2-amine
CID 81248517
2-methyl-N-[[5-methyl-6-(2-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 80629769
N-[[4-methyl-2-(2-methylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine
CID 83186348
2-methyl-N-[[2-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-1-amine
CID 113388089
5-methyl-4-(2-methylpiperidin-1-yl)-N-propylpyrimidin-2-amine
CID 80767020

Frequently Asked Questions

What is the IUPAC name of N-[[2-methyl-4-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-2-amine?
The IUPAC name of N-[[2-methyl-4-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-2-amine (CID 114215748) is N-[[2-methyl-4-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[2-methyl-4-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[2-methyl-4-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-2-amine is Cc1ncc(CNC(C)C)c(N2CCCC2C)n1.
What is the InChIKey of N-[[2-methyl-4-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-2-amine?
The InChIKey is ITCMRXNISVMYBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-10(2)15-8-13-9-16-12(4)17-14(13)18-7-5-6-11(18)3/h9-11,15H,5-8H2,1-4H3.
What are the key properties of N-[[2-methyl-4-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-2-amine?
N-[[2-methyl-4-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-2-amine has a molecular weight of 248.37 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-methyl-4-(2-methylpyrrolidin-1-yl)pyrimidin-5-yl]methyl]propan-2-amine is sourced from PubChem (CID 114215748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).