N-(2,2-dimethylpropyl)-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine

C14H25N5 — CID 67156404

IUPACN-(2,2-dimethylpropyl)-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine
SMILESCN[C@@H]1CCN(c2cc(NCC(C)(C)C)ncn2)C1
InChIInChI=1S/C14H25N5/c1-14(2,3)9-16-12-7-13(18-10-17-12)19-6-5-11(8-19)15-4/h7,10-11,15H,5-6,8-9H2,1-4H3,(H,16,17,18)/t11-/m1/s1
InChIKeyRAWFSNVTRJXSSX-LLVKDONJSA-N
MW263.39 g/mol
LogP1.73
Rot. Bonds4

About N-(2,2-dimethylpropyl)-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine

N-(2,2-dimethylpropyl)-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine (PubChem CID 67156404) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine
PubChem CID67156404
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC NameN-(2,2-dimethylpropyl)-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine
SMILESCN[C@@H]1CCN(c2cc(NCC(C)(C)C)ncn2)C1
InChIInChI=1S/C14H25N5/c1-14(2,3)9-16-12-7-13(18-10-17-12)19-6-5-11(8-19)15-4/h7,10-11,15H,5-6,8-9H2,1-4H3,(H,16,17,18)/t11-/m1/s1
InChIKeyRAWFSNVTRJXSSX-LLVKDONJSA-N
XLogP1.73
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2S)-butan-2-yl]-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine
CID 69150898
N-methyl-1-(6-methylsulfanylpyrimidin-4-yl)pyrrolidin-3-amine
CID 106973300
N-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine
CID 62545669
1-(6-ethylpyrimidin-4-yl)-N-methylpiperidin-3-amine
CID 62545846
4-methyl-1-[6-(propylamino)pyrimidin-4-yl]piperidin-3-ol
CID 102971029
6-[3-(dimethylamino)pyrrolidin-1-yl]-N-propylpyrimidin-4-amine
CID 80831792
1-[6-(ethylamino)pyrimidin-4-yl]pyrrolidine-3,4-diol
CID 106674454
6-[4-(2-methoxypropan-2-yl)piperidin-1-yl]-N-methylpyrimidin-4-amine
CID 166315850
N-ethyl-6-(3-phenylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80822469
N-[(1-methoxycyclobutyl)methyl]-6-(3-methylpiperidin-1-yl)pyrimidin-4-amine
CID 133459927
[1-[6-[[2-methyl-2-(3-methylphenyl)propyl]amino]pyrimidin-4-yl]piperidin-3-yl]methanol
CID 133304152
N-ethyl-6-(4-propylazepan-1-yl)pyrimidin-4-amine
CID 80837648

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine?
The IUPAC name of N-(2,2-dimethylpropyl)-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine (CID 67156404) is N-(2,2-dimethylpropyl)-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine.
What is the SMILES notation for N-(2,2-dimethylpropyl)-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine?
The canonical SMILES for N-(2,2-dimethylpropyl)-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine is CN[C@@H]1CCN(c2cc(NCC(C)(C)C)ncn2)C1.
What is the InChIKey of N-(2,2-dimethylpropyl)-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine?
The InChIKey is RAWFSNVTRJXSSX-LLVKDONJSA-N. The full InChI is InChI=1S/C14H25N5/c1-14(2,3)9-16-12-7-13(18-10-17-12)19-6-5-11(8-19)15-4/h7,10-11,15H,5-6,8-9H2,1-4H3,(H,16,17,18)/t11-/m1/s1.
What are the key properties of N-(2,2-dimethylpropyl)-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine?
N-(2,2-dimethylpropyl)-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine has a molecular weight of 263.39 g/mol, XLogP of 1.73, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)-6-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-4-amine is sourced from PubChem (CID 67156404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).