5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine

C14H24N4O — CID 80992035

IUPAC5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine
SMILESCCCc1nc(N)c(C)c(NCC2(C)CCCO2)n1
InChIInChI=1S/C14H24N4O/c1-4-6-11-17-12(15)10(2)13(18-11)16-9-14(3)7-5-8-19-14/h4-9H2,1-3H3,(H3,15,16,17,18)
InChIKeyFBZYHHDSCVGWSI-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.30
Rot. Bonds5

About 5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine

5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine (PubChem CID 80992035) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine
PubChem CID80992035
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine
SMILESCCCc1nc(N)c(C)c(NCC2(C)CCCO2)n1
InChIInChI=1S/C14H24N4O/c1-4-6-11-17-12(15)10(2)13(18-11)16-9-14(3)7-5-8-19-14/h4-9H2,1-3H3,(H3,15,16,17,18)
InChIKeyFBZYHHDSCVGWSI-UHFFFAOYSA-N
XLogP2.30
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-N-ethyl-5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine
CID 80991523
3-N-[(2-methyloxolan-2-yl)methyl]quinoxaline-2,3-diamine
CID 102984701
5-methyl-4-N-(3-methylbutyl)-2-propylpyrimidine-4,6-diamine
CID 80981770
2-N-ethyl-5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]pyrimidine-2,4-diamine
CID 80854891
5-methyl-2-propyl-4-N-(2,2,2-trifluoroethyl)pyrimidine-4,6-diamine
CID 80981416
4-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)amino]butanamide
CID 80994095
N-[2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)amino]ethyl]methanesulfonamide
CID 80993418
4-N-[2-(furan-2-yl)ethyl]-5-methyl-2-propylpyrimidine-4,6-diamine
CID 80987278
5-methyl-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-propylpyrimidine-4,6-diamine
CID 80983242
5-methyl-2-propyl-4-N-(2,3,3-trimethylbutyl)pyrimidine-4,6-diamine
CID 83146362
2-[(6-amino-5-methyl-2-propylpyrimidin-4-yl)amino]-2-ethylbutan-1-ol
CID 80983002
5-methyl-4-N-[2-[methyl(propan-2-yl)amino]ethyl]-2-propylpyrimidine-4,6-diamine
CID 80983070

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine?
The IUPAC name of 5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine (CID 80992035) is 5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine.
What is the SMILES notation for 5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine?
The canonical SMILES for 5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine is CCCc1nc(N)c(C)c(NCC2(C)CCCO2)n1.
What is the InChIKey of 5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine?
The InChIKey is FBZYHHDSCVGWSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-4-6-11-17-12(15)10(2)13(18-11)16-9-14(3)7-5-8-19-14/h4-9H2,1-3H3,(H3,15,16,17,18).
What are the key properties of 5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine?
5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine has a molecular weight of 264.37 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-N-[(2-methyloxolan-2-yl)methyl]-2-propylpyrimidine-4,6-diamine is sourced from PubChem (CID 80992035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).