N-[(5-cyclopropyloxolan-2-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine

C18H22N4O — CID 154867733

IUPACN-[(5-cyclopropyloxolan-2-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine
SMILESCc1nc(NCC2CCC(C3CC3)O2)cc(-c2ccccn2)n1
InChIInChI=1S/C18H22N4O/c1-12-21-16(15-4-2-3-9-19-15)10-18(22-12)20-11-14-7-8-17(23-14)13-5-6-13/h2-4,9-10,13-14,17H,5-8,11H2,1H3,(H,20,21,22)
InChIKeyLJJUUHQFOUNJPB-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.22
Rot. Bonds5

About N-[(5-cyclopropyloxolan-2-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine

N-[(5-cyclopropyloxolan-2-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine (PubChem CID 154867733) has the molecular formula C18H22N4O and a molecular weight of 310.40 g/mol. Its IUPAC name is N-[(5-cyclopropyloxolan-2-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[(5-cyclopropyloxolan-2-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine
PubChem CID154867733
Molecular FormulaC18H22N4O
Molecular Weight310.40 g/mol
Exact Mass310.18
IUPAC NameN-[(5-cyclopropyloxolan-2-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine
SMILESCc1nc(NCC2CCC(C3CC3)O2)cc(-c2ccccn2)n1
InChIInChI=1S/C18H22N4O/c1-12-21-16(15-4-2-3-9-19-15)10-18(22-12)20-11-14-7-8-17(23-14)13-5-6-13/h2-4,9-10,13-14,17H,5-8,11H2,1H3,(H,20,21,22)
InChIKeyLJJUUHQFOUNJPB-UHFFFAOYSA-N
XLogP3.22
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

trans-(1S,2S)-2-[[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 154869671
2-methyl-N-[[1-(oxan-4-yl)azetidin-2-yl]methyl]-6-pyridin-2-ylpyrimidin-4-amine
CID 154867730
1-methyl-4-[[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]methyl]pyrrolidin-2-one
CID 154865732
2-[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]-1-(oxolan-2-yl)ethanol
CID 154866099
2-methyl-N-(3-morpholin-4-ylpropyl)-6-pyridin-2-ylpyrimidin-4-amine
CID 4193041
2-methyl-N-[(4-methyl-2-oxabicyclo[2.2.1]heptan-1-yl)methyl]-6-pyridin-2-ylpyrimidin-4-amine
CID 167917212
methyl 2-[3-[[(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)amino]methyl]piperidin-1-yl]acetate;2,2,2-trifluoroacetic acid
CID 167811198
N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)-2-methyl-6-pyridin-2-ylpyrimidin-4-amine
CID 154870329
N-(2,2-dimethylthietan-3-yl)-2-methyl-6-pyridin-2-ylpyrimidin-4-amine
CID 167873088
2-ethyl-N-(piperidin-4-ylmethyl)-6-pyridin-2-ylpyrimidin-4-amine
CID 56768213
N,N-dimethyl-N'-(2-methyl-6-pyridin-2-ylpyrimidin-4-yl)-2-phenylpropane-1,3-diamine
CID 167775142
N-[(1-benzyl-5-methylpyrrolidin-3-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine;2,2,2-trifluoroacetic acid
CID 154859329

Frequently Asked Questions

What is the IUPAC name of N-[(5-cyclopropyloxolan-2-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine?
The IUPAC name of N-[(5-cyclopropyloxolan-2-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine (CID 154867733) is N-[(5-cyclopropyloxolan-2-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-[(5-cyclopropyloxolan-2-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine?
The canonical SMILES for N-[(5-cyclopropyloxolan-2-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine is Cc1nc(NCC2CCC(C3CC3)O2)cc(-c2ccccn2)n1.
What is the InChIKey of N-[(5-cyclopropyloxolan-2-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine?
The InChIKey is LJJUUHQFOUNJPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O/c1-12-21-16(15-4-2-3-9-19-15)10-18(22-12)20-11-14-7-8-17(23-14)13-5-6-13/h2-4,9-10,13-14,17H,5-8,11H2,1H3,(H,20,21,22).
What are the key properties of N-[(5-cyclopropyloxolan-2-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine?
N-[(5-cyclopropyloxolan-2-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine has a molecular weight of 310.40 g/mol, XLogP of 3.22, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-cyclopropyloxolan-2-yl)methyl]-2-methyl-6-pyridin-2-ylpyrimidin-4-amine is sourced from PubChem (CID 154867733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).