N,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide

C15H25N5O — CID 106322336

IUPACN,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide
SMILESCNC(=O)C1(C)CCN(c2cc(NC)nc(C(C)C)n2)C1
InChIInChI=1S/C15H25N5O/c1-10(2)13-18-11(16-4)8-12(19-13)20-7-6-15(3,9-20)14(21)17-5/h8,10H,6-7,9H2,1-5H3,(H,17,21)(H,16,18,19)
InChIKeyBJYAFYXFCAMCJH-UHFFFAOYSA-N
MW291.40 g/mol
LogP1.60
Rot. Bonds4

About N,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide

N,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide (PubChem CID 106322336) has the molecular formula C15H25N5O and a molecular weight of 291.40 g/mol. Its IUPAC name is N,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide
PubChem CID106322336
Molecular FormulaC15H25N5O
Molecular Weight291.40 g/mol
Exact Mass291.21
IUPAC NameN,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide
SMILESCNC(=O)C1(C)CCN(c2cc(NC)nc(C(C)C)n2)C1
InChIInChI=1S/C15H25N5O/c1-10(2)13-18-11(16-4)8-12(19-13)20-7-6-15(3,9-20)14(21)17-5/h8,10H,6-7,9H2,1-5H3,(H,17,21)(H,16,18,19)
InChIKeyBJYAFYXFCAMCJH-UHFFFAOYSA-N
XLogP1.60
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(6-amino-2-propan-2-ylpyrimidin-4-yl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106322370
4-methyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidin-4-ol
CID 81107552
6-(4,4-dimethylazepan-1-yl)-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80960267
N-methyl-2-propan-2-yl-6-pyrrolidin-1-ylpyrimidin-4-amine
CID 80956947
1-(6-chloro-5-methyl-2-propan-2-ylpyrimidin-4-yl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106321030
1-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 106322365
N,3-dimethyl-1-[2-(methylamino)pyrimidin-4-yl]pyrrolidine-3-carboxamide
CID 106322389
6-(3,3-dimethylpyrrolidin-1-yl)-N-ethyl-2-propan-2-ylpyrimidin-4-amine
CID 80959385
6-(4-cyclopropylpiperazin-1-yl)-N-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80962074
1-(4-carbamothioyl-6-methyl-2-pyridinyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106318515
1-(6-chloro-4-nitro-2-pyridinyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106150503
3-methyl-1-(2-propan-2-ylpyrimidin-4-yl)pyrrolidine-3-carboxylic acid
CID 122052448

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide?
The IUPAC name of N,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide (CID 106322336) is N,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide.
What is the SMILES notation for N,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide?
The canonical SMILES for N,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide is CNC(=O)C1(C)CCN(c2cc(NC)nc(C(C)C)n2)C1.
What is the InChIKey of N,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide?
The InChIKey is BJYAFYXFCAMCJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O/c1-10(2)13-18-11(16-4)8-12(19-13)20-7-6-15(3,9-20)14(21)17-5/h8,10H,6-7,9H2,1-5H3,(H,17,21)(H,16,18,19).
What are the key properties of N,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide?
N,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide has a molecular weight of 291.40 g/mol, XLogP of 1.60, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-1-[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 106322336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).