1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide

C14H21N5O — CID 80987630

IUPAC1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1c1nc(C2CC2)nc(N)c1C
InChIInChI=1S/C14H21N5O/c1-8-11(15)17-12(9-5-6-9)18-13(8)19-7-3-4-10(19)14(20)16-2/h9-10H,3-7H2,1-2H3,(H,16,20)(H2,15,17,18)
InChIKeyZGQSOSGSSWELLE-UHFFFAOYSA-N
MW275.36 g/mol
LogP0.96
Rot. Bonds3

About 1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide

1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide (PubChem CID 80987630) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is 1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
PubChem CID80987630
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1c1nc(C2CC2)nc(N)c1C
InChIInChI=1S/C14H21N5O/c1-8-11(15)17-12(9-5-6-9)18-13(8)19-7-3-4-10(19)14(20)16-2/h9-10H,3-7H2,1-2H3,(H,16,20)(H2,15,17,18)
InChIKeyZGQSOSGSSWELLE-UHFFFAOYSA-N
XLogP0.96
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]-N-methylpyrrolidine-2-carboxamide
CID 80987629
1-(6-chloro-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
CID 80971406
1-(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-N-methylpiperidine-2-carboxamide
CID 80986924
1-(6-amino-5-methyl-2-propylpyrimidin-4-yl)-N-methylpiperidine-2-carboxamide
CID 80986923
1-[6-(ethylamino)-2,5-dimethylpyrimidin-4-yl]-N-methylpyrrolidine-2-carboxamide
CID 80805785
1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
CID 80994938
1-(2-amino-5-chloropyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
CID 80806767
1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide
CID 80806267
1-(6-amino-5-nitropyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
CID 80806765
1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-6-methylpiperidine-3-carboxamide
CID 80987847
1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide
CID 104540139
1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
CID 80905623

Frequently Asked Questions

What is the IUPAC name of 1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide?
The IUPAC name of 1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide (CID 80987630) is 1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide is CNC(=O)C1CCCN1c1nc(C2CC2)nc(N)c1C.
What is the InChIKey of 1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide?
The InChIKey is ZGQSOSGSSWELLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-8-11(15)17-12(9-5-6-9)18-13(8)19-7-3-4-10(19)14(20)16-2/h9-10H,3-7H2,1-2H3,(H,16,20)(H2,15,17,18).
What are the key properties of 1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide?
1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide has a molecular weight of 275.36 g/mol, XLogP of 0.96, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 80987630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).