4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine

C15H17N3 — CID 114207036

IUPAC4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine
SMILESCc1nc(C2(c3ccccc3)CCC2)ncc1N
InChIInChI=1S/C15H17N3/c1-11-13(16)10-17-14(18-11)15(8-5-9-15)12-6-3-2-4-7-12/h2-4,6-7,10H,5,8-9,16H2,1H3
InChIKeyOIHUVJGDQFANCY-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.84
Rot. Bonds2

About 4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine

4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine (PubChem CID 114207036) has the molecular formula C15H17N3 and a molecular weight of 239.32 g/mol. Its IUPAC name is 4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine.

Molecular Properties

Compound Name4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine
PubChem CID114207036
Molecular FormulaC15H17N3
Molecular Weight239.32 g/mol
Exact Mass239.14
IUPAC Name4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine
SMILESCc1nc(C2(c3ccccc3)CCC2)ncc1N
InChIInChI=1S/C15H17N3/c1-11-13(16)10-17-14(18-11)15(8-5-9-15)12-6-3-2-4-7-12/h2-4,6-7,10H,5,8-9,16H2,1H3
InChIKeyOIHUVJGDQFANCY-UHFFFAOYSA-N
XLogP2.84
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-yl]ethanamine
CID 63079527
4-amino-2-(1-phenylcyclopentyl)pyrimidine-5-carboxylic acid
CID 116640865
4-ethyl-2-(1-phenylcyclobutyl)pyrimidine-5-carboxylic acid
CID 63080630
4-chloro-5-iodo-6-methyl-2-(1-phenylcyclobutyl)pyrimidine
CID 66292727
5-(aminomethyl)-2-(1-phenylcyclopropyl)pyrimidin-4-amine
CID 64574343
6-methyl-2-(1-phenylcyclopropyl)-5-propan-2-ylpyrimidin-4-amine
CID 63078471
4-tert-butyl-6-(1-phenylcyclobutyl)-1,3,5-triazin-2-amine
CID 63867465
2-(1-phenylcyclopentyl)pyrimidine-5-carboxylic acid
CID 63080980
3-[3-(1-phenylcyclobutyl)-1,2,4-oxadiazol-5-yl]butan-2-amine
CID 63350169
2-[2-(1-phenylcyclopentyl)pyrimidin-5-yl]ethanamine
CID 63079037
6-(1-phenylcyclopropyl)-1,3,5-triazine-2,4-diamine
CID 112681528
methyl 2-amino-4-(1-phenylcyclopentyl)pyrimidine-5-carboxylate
CID 143562143

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine?
The IUPAC name of 4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine (CID 114207036) is 4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine.
What is the SMILES notation for 4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine?
The canonical SMILES for 4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine is Cc1nc(C2(c3ccccc3)CCC2)ncc1N.
What is the InChIKey of 4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine?
The InChIKey is OIHUVJGDQFANCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3/c1-11-13(16)10-17-14(18-11)15(8-5-9-15)12-6-3-2-4-7-12/h2-4,6-7,10H,5,8-9,16H2,1H3.
What are the key properties of 4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine?
4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine has a molecular weight of 239.32 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(1-phenylcyclobutyl)pyrimidin-5-amine is sourced from PubChem (CID 114207036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).