6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine

C14H22N4 — CID 61227101

IUPAC6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine
SMILESCc1cc(NCC2CC3CCC(C2)N3C)ncn1
InChIInChI=1S/C14H22N4/c1-10-5-14(17-9-16-10)15-8-11-6-12-3-4-13(7-11)18(12)2/h5,9,11-13H,3-4,6-8H2,1-2H3,(H,15,16,17)
InChIKeyCJCORPDTQXXFRJ-UHFFFAOYSA-N
MW246.36 g/mol
LogP2.07
Rot. Bonds3

About 6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine

6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine (PubChem CID 61227101) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is 6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine
PubChem CID61227101
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC Name6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine
SMILESCc1cc(NCC2CC3CCC(C2)N3C)ncn1
InChIInChI=1S/C14H22N4/c1-10-5-14(17-9-16-10)15-8-11-6-12-3-4-13(7-11)18(12)2/h5,9,11-13H,3-4,6-8H2,1-2H3,(H,15,16,17)
InChIKeyCJCORPDTQXXFRJ-UHFFFAOYSA-N
XLogP2.07
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine with MolForge

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Related Compounds

6-fluoro-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine
CID 114156479
N-[(3-aminocyclopentyl)methyl]-6-methylpyrimidin-4-amine
CID 106126678
N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyridin-2-amine
CID 61012196
5-methoxy-2-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyridin-4-amine
CID 106660339
2-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrazolo[1,5-a]pyrazin-4-amine
CID 104730858
6-chloro-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-5-propan-2-ylpyrimidin-4-amine
CID 106193279
4,6-dimethyl-2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methylamino]pyridine-3-carbonitrile
CID 61012193
6-methyl-N-[[(2S)-1-(2-methylpropyl)pyrrolidin-2-yl]methyl]pyrimidin-4-amine
CID 133417435
2,6-dimethyl-4-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methylamino]pyridine-3-carbonitrile
CID 81036499
5-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 65209321
6-methyl-N-(thian-2-ylmethyl)pyrimidin-4-amine
CID 80612498
1-[(6-methylpyrimidin-4-yl)amino]propan-2-ol
CID 61226295

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine?
The IUPAC name of 6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine (CID 61227101) is 6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for 6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine is Cc1cc(NCC2CC3CCC(C2)N3C)ncn1.
What is the InChIKey of 6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine?
The InChIKey is CJCORPDTQXXFRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c1-10-5-14(17-9-16-10)15-8-11-6-12-3-4-13(7-11)18(12)2/h5,9,11-13H,3-4,6-8H2,1-2H3,(H,15,16,17).
What are the key properties of 6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine?
6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine has a molecular weight of 246.36 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 61227101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).