N-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide

C15H25N5O — CID 80786025

IUPACN-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide
SMILESCCCNc1ncnc(N2CCCCC2C(=O)NC)c1C
InChIInChI=1S/C15H25N5O/c1-4-8-17-13-11(2)14(19-10-18-13)20-9-6-5-7-12(20)15(21)16-3/h10,12H,4-9H2,1-3H3,(H,16,21)(H,17,18,19)
InChIKeyWOTQZRQFVHGDMA-UHFFFAOYSA-N
MW291.40 g/mol
LogP1.71
Rot. Bonds5

About N-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide

N-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide (PubChem CID 80786025) has the molecular formula C15H25N5O and a molecular weight of 291.40 g/mol. Its IUPAC name is N-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide
PubChem CID80786025
Molecular FormulaC15H25N5O
Molecular Weight291.40 g/mol
Exact Mass291.21
IUPAC NameN-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide
SMILESCCCNc1ncnc(N2CCCCC2C(=O)NC)c1C
InChIInChI=1S/C15H25N5O/c1-4-8-17-13-11(2)14(19-10-18-13)20-9-6-5-7-12(20)15(21)16-3/h10,12H,4-9H2,1-3H3,(H,16,21)(H,17,18,19)
InChIKeyWOTQZRQFVHGDMA-UHFFFAOYSA-N
XLogP1.71
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide 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-[5-ethyl-6-(propylamino)pyrimidin-4-yl]-N-methylpyrrolidine-2-carboxamide
CID 80785472
N-methyl-4-[5-methyl-6-(propylamino)pyrimidin-4-yl]morpholine-3-carboxamide
CID 83105081
5-methyl-6-(2-methylpiperidin-1-yl)-N-propylpyrimidin-4-amine
CID 80766852
1-[6-(ethylamino)-5-propylpyrimidin-4-yl]-N-methylpyrrolidine-2-carboxamide
CID 80785994
6-(2-cyclopentylpyrrolidin-1-yl)-5-methyl-N-propylpyrimidin-4-amine
CID 80792872
6-(2-ethylpyrrolidin-1-yl)-5-methyl-N-propylpyrimidin-4-amine
CID 80797292
1-[5-chloro-2-(propylamino)pyrimidin-4-yl]-N-methylpiperidine-2-carboxamide
CID 80784866
N-ethyl-5-methyl-6-(2-methylpiperidin-1-yl)pyrimidin-4-amine
CID 80767326
1-[6-(ethylamino)-2,5-dimethylpyrimidin-4-yl]-N-methylpyrrolidine-2-carboxamide
CID 80805785
[1-[6-(ethylamino)-5-methylpyrimidin-4-yl]azepan-2-yl]methanol
CID 116640640
1-[2-amino-6-(propylamino)pyrimidin-4-yl]-N-methylpiperidine-2-carboxamide
CID 80785772
1-[5-methyl-6-(propylamino)pyrimidin-4-yl]pyrrolidin-3-ol
CID 80823831

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide?
The IUPAC name of N-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide (CID 80786025) is N-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide.
What is the SMILES notation for N-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide?
The canonical SMILES for N-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide is CCCNc1ncnc(N2CCCCC2C(=O)NC)c1C.
What is the InChIKey of N-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide?
The InChIKey is WOTQZRQFVHGDMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O/c1-4-8-17-13-11(2)14(19-10-18-13)20-9-6-5-7-12(20)15(21)16-3/h10,12H,4-9H2,1-3H3,(H,16,21)(H,17,18,19).
What are the key properties of N-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide?
N-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide has a molecular weight of 291.40 g/mol, XLogP of 1.71, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[5-methyl-6-(propylamino)pyrimidin-4-yl]piperidine-2-carboxamide is sourced from PubChem (CID 80786025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).