N,6-dimethyl-2-[(2S)-2-methylpyrrolidin-2-yl]pyrimidin-4-amine

C11H18N4 — CID 124946836

IUPACN,6-dimethyl-2-[(2S)-2-methylpyrrolidin-2-yl]pyrimidin-4-amine
SMILESCNc1cc(C)nc([C@]2(C)CCCN2)n1
InChIInChI=1S/C11H18N4/c1-8-7-9(12-3)15-10(14-8)11(2)5-4-6-13-11/h7,13H,4-6H2,1-3H3,(H,12,14,15)/t11-/m0/s1
InChIKeyCBFOBVPVDYRHNQ-NSHDSACASA-N
MW206.29 g/mol
LogP1.43
Rot. Bonds2

About N,6-dimethyl-2-[(2S)-2-methylpyrrolidin-2-yl]pyrimidin-4-amine

N,6-dimethyl-2-[(2S)-2-methylpyrrolidin-2-yl]pyrimidin-4-amine (PubChem CID 124946836) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is N,6-dimethyl-2-[(2S)-2-methylpyrrolidin-2-yl]pyrimidin-4-amine.

Molecular Properties

Compound NameN,6-dimethyl-2-[(2S)-2-methylpyrrolidin-2-yl]pyrimidin-4-amine
PubChem CID124946836
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC NameN,6-dimethyl-2-[(2S)-2-methylpyrrolidin-2-yl]pyrimidin-4-amine
SMILESCNc1cc(C)nc([C@]2(C)CCCN2)n1
InChIInChI=1S/C11H18N4/c1-8-7-9(12-3)15-10(14-8)11(2)5-4-6-13-11/h7,13H,4-6H2,1-3H3,(H,12,14,15)/t11-/m0/s1
InChIKeyCBFOBVPVDYRHNQ-NSHDSACASA-N
XLogP1.43
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N,2-dimethyl-6-(4-methylpiperidin-4-yl)pyrimidin-4-amine
CID 73440701
6-fluoro-2-methyl-4-(2-methylpyrrolidin-2-yl)quinoline
CID 82664652
(2,4-dimethyl-1,3-thiazol-5-yl)-[2-methyl-2-[4-methyl-6-(methylamino)pyrimidin-2-yl]pyrrolidin-1-yl]methanone
CID 127245527
5,7-dimethyl-3-(2-methylpiperidin-2-yl)-[1,2,4]triazolo[4,3-a]pyrimidine
CID 113430954
2-(4-chloro-3-methylphenyl)-2-methylpyrrolidine
CID 117299725
2-methyl-2-(2,3,4,5-tetrafluorophenyl)pyrrolidine
CID 117116945
2-methyl-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)pyrrolidine
CID 117455663
2-(3-bromo-5-fluoro-2-methylphenyl)-2-methylpyrrolidine
CID 117432844
4-methyl-1-[[4-methyl-6-(methylamino)pyrimidin-2-yl]methyl]piperidin-4-ol
CID 81102789
5-(4-fluorophenyl)-3-(2-methylpiperidin-2-yl)-1,2,4-oxadiazole
CID 172908876
2-(2,4-difluoro-5-methylphenyl)-2-methylpyrrolidine
CID 117301639
2-(2,5-difluoro-4-methylphenyl)-2-methylpyrrolidine
CID 117301641

Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-2-[(2S)-2-methylpyrrolidin-2-yl]pyrimidin-4-amine?
The IUPAC name of N,6-dimethyl-2-[(2S)-2-methylpyrrolidin-2-yl]pyrimidin-4-amine (CID 124946836) is N,6-dimethyl-2-[(2S)-2-methylpyrrolidin-2-yl]pyrimidin-4-amine.
What is the SMILES notation for N,6-dimethyl-2-[(2S)-2-methylpyrrolidin-2-yl]pyrimidin-4-amine?
The canonical SMILES for N,6-dimethyl-2-[(2S)-2-methylpyrrolidin-2-yl]pyrimidin-4-amine is CNc1cc(C)nc([C@]2(C)CCCN2)n1.
What is the InChIKey of N,6-dimethyl-2-[(2S)-2-methylpyrrolidin-2-yl]pyrimidin-4-amine?
The InChIKey is CBFOBVPVDYRHNQ-NSHDSACASA-N. The full InChI is InChI=1S/C11H18N4/c1-8-7-9(12-3)15-10(14-8)11(2)5-4-6-13-11/h7,13H,4-6H2,1-3H3,(H,12,14,15)/t11-/m0/s1.
What are the key properties of N,6-dimethyl-2-[(2S)-2-methylpyrrolidin-2-yl]pyrimidin-4-amine?
N,6-dimethyl-2-[(2S)-2-methylpyrrolidin-2-yl]pyrimidin-4-amine has a molecular weight of 206.29 g/mol, XLogP of 1.43, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-2-[(2S)-2-methylpyrrolidin-2-yl]pyrimidin-4-amine is sourced from PubChem (CID 124946836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).