6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine

C14H22N4 — CID 110271708

IUPAC6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine
SMILESCc1nc(N)cc(C2CCN2C2CCCCC2)n1
InChIInChI=1S/C14H22N4/c1-10-16-12(9-14(15)17-10)13-7-8-18(13)11-5-3-2-4-6-11/h9,11,13H,2-8H2,1H3,(H2,15,16,17)
InChIKeyFCRFAHAOBQUKQG-UHFFFAOYSA-N
MW246.36 g/mol
LogP2.45
Rot. Bonds2

About 6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine

6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine (PubChem CID 110271708) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is 6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine
PubChem CID110271708
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC Name6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine
SMILESCc1nc(N)cc(C2CCN2C2CCCCC2)n1
InChIInChI=1S/C14H22N4/c1-10-16-12(9-14(15)17-10)13-7-8-18(13)11-5-3-2-4-6-11/h9,11,13H,2-8H2,1H3,(H2,15,16,17)
InChIKeyFCRFAHAOBQUKQG-UHFFFAOYSA-N
XLogP2.45
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-6-[1-(1-methylsulfonylpiperidin-4-yl)pyrrolidin-2-yl]pyrimidin-4-amine
CID 110091082
6-[(2R)-1-cyclohexylsulfonylpyrrolidin-2-yl]-2-methylpyrimidin-4-amine
CID 124983194
6-[(2R)-4-cyclohexylmorpholin-2-yl]-2-methylpyrimidin-4-amine
CID 95847530
6-[(2R)-1-(2-methoxyethyl)azetidin-2-yl]-2-methylpyrimidin-4-amine
CID 95847238
4-[[(2S)-2-(6-amino-2-methylpyrimidin-4-yl)azetidin-1-yl]methyl]phenol
CID 95847351
N-[6-[(2R)-1-cyclopentylpyrrolidin-2-yl]-2-methylpyrimidin-4-yl]-5-methyl-1,3,4-thiadiazol-2-amine
CID 95820334
6-[(2S)-1-[(4-methoxyphenyl)methyl]azetidin-2-yl]-2-methylpyrimidin-4-amine
CID 95847401
4-N-cyclooctyl-2-methylpyrimidine-4,6-diamine
CID 80786651
6-[1-(benzenesulfonyl)pyrrolidin-2-yl]-2-methylpyrimidin-4-amine
CID 110091079
6-(2-cyclohexylethyl)-2-methylpyrimidin-4-amine
CID 122238954
[(2S)-2-(6-amino-2-methylpyrimidin-4-yl)pyrrolidin-1-yl]-(4-methyl-1,3-oxazol-5-yl)methanone
CID 124993727
[1-(6-amino-2-methylpyrimidin-4-yl)piperidin-2-yl]methanol
CID 80794563

Frequently Asked Questions

What is the IUPAC name of 6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine?
The IUPAC name of 6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine (CID 110271708) is 6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine.
What is the SMILES notation for 6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine?
The canonical SMILES for 6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine is Cc1nc(N)cc(C2CCN2C2CCCCC2)n1.
What is the InChIKey of 6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine?
The InChIKey is FCRFAHAOBQUKQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c1-10-16-12(9-14(15)17-10)13-7-8-18(13)11-5-3-2-4-6-11/h9,11,13H,2-8H2,1H3,(H2,15,16,17).
What are the key properties of 6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine?
6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine has a molecular weight of 246.36 g/mol, XLogP of 2.45, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-cyclohexylazetidin-2-yl)-2-methylpyrimidin-4-amine is sourced from PubChem (CID 110271708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).