ethane;5-fluoro-4-methoxy-N,N-dimethyl-6-propylpyrimidin-2-amine

C14H28FN3O — CID 143883690

IUPACethane;5-fluoro-4-methoxy-N,N-dimethyl-6-propylpyrimidin-2-amine
SMILESCC.CC.CCCc1nc(N(C)C)nc(OC)c1F
InChIInChI=1S/C10H16FN3O.2C2H6/c1-5-6-7-8(11)9(15-4)13-10(12-7)14(2)3;2*1-2/h5-6H2,1-4H3;2*1-2H3
InChIKeyRRLYBOONFXKYFE-UHFFFAOYSA-N
MW273.40 g/mol
LogP3.70
Rot. Bonds4

About ethane;5-fluoro-4-methoxy-N,N-dimethyl-6-propylpyrimidin-2-amine

ethane;5-fluoro-4-methoxy-N,N-dimethyl-6-propylpyrimidin-2-amine (PubChem CID 143883690) has the molecular formula C14H28FN3O and a molecular weight of 273.40 g/mol. Its IUPAC name is ethane;5-fluoro-4-methoxy-N,N-dimethyl-6-propylpyrimidin-2-amine.

Molecular Properties

Compound Nameethane;5-fluoro-4-methoxy-N,N-dimethyl-6-propylpyrimidin-2-amine
PubChem CID143883690
Molecular FormulaC14H28FN3O
Molecular Weight273.40 g/mol
Exact Mass273.22
IUPAC Nameethane;5-fluoro-4-methoxy-N,N-dimethyl-6-propylpyrimidin-2-amine
SMILESCC.CC.CCCc1nc(N(C)C)nc(OC)c1F
InChIInChI=1S/C10H16FN3O.2C2H6/c1-5-6-7-8(11)9(15-4)13-10(12-7)14(2)3;2*1-2/h5-6H2,1-4H3;2*1-2H3
InChIKeyRRLYBOONFXKYFE-UHFFFAOYSA-N
XLogP3.70
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.40
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethene;4-ethyl-5-fluoro-6-methoxy-N,N-dimethylpyrimidin-2-amine;fluoromethane
CID 143883720
5-fluoro-4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine;fluoroethene
CID 143883755
4-but-3-enyl-2-(dimethylamino)-6-methoxypyrimidin-5-ol
CID 121006175
5-fluoro-2,4,6-trimethoxypyrimidine
CID 71349957
CID 174135085
CID 174135085
azane;2-N,2-N,4-N,4-N,6-N,6-N-hexamethyl-1,3,5-triazine-2,4,6-triamine
CID 159451135
6-(3,4-dimethoxypyrrolidin-1-yl)-2-N-ethyl-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 103542047
4,6-difluoro-N,N-dimethylpyrimidin-2-amine
CID 594438
6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 793255
2-methoxy-4-propyl-1,3-thiazole-5-carboxylic acid
CID 19885485
4-N-ethyl-2-N,2-N-dimethyl-6-pentan-2-yloxy-1,3,5-triazine-2,4-diamine
CID 102989484
3-methoxy-2-methyl-5-propylpyrazine
CID 154131793

Frequently Asked Questions

What is the IUPAC name of ethane;5-fluoro-4-methoxy-N,N-dimethyl-6-propylpyrimidin-2-amine?
The IUPAC name of ethane;5-fluoro-4-methoxy-N,N-dimethyl-6-propylpyrimidin-2-amine (CID 143883690) is ethane;5-fluoro-4-methoxy-N,N-dimethyl-6-propylpyrimidin-2-amine.
What is the SMILES notation for ethane;5-fluoro-4-methoxy-N,N-dimethyl-6-propylpyrimidin-2-amine?
The canonical SMILES for ethane;5-fluoro-4-methoxy-N,N-dimethyl-6-propylpyrimidin-2-amine is CC.CC.CCCc1nc(N(C)C)nc(OC)c1F.
What is the InChIKey of ethane;5-fluoro-4-methoxy-N,N-dimethyl-6-propylpyrimidin-2-amine?
The InChIKey is RRLYBOONFXKYFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FN3O.2C2H6/c1-5-6-7-8(11)9(15-4)13-10(12-7)14(2)3;2*1-2/h5-6H2,1-4H3;2*1-2H3.
What are the key properties of ethane;5-fluoro-4-methoxy-N,N-dimethyl-6-propylpyrimidin-2-amine?
ethane;5-fluoro-4-methoxy-N,N-dimethyl-6-propylpyrimidin-2-amine has a molecular weight of 273.40 g/mol, XLogP of 3.70, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-fluoro-4-methoxy-N,N-dimethyl-6-propylpyrimidin-2-amine is sourced from PubChem (CID 143883690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).