6-(4-chlorophenyl)-5-methyl-N-(2-piperidin-1-ylethyl)furo[2,3-d]pyrimidin-4-amine

C20H23ClN4O — CID 11552448

IUPAC6-(4-chlorophenyl)-5-methyl-N-(2-piperidin-1-ylethyl)furo[2,3-d]pyrimidin-4-amine
SMILESCc1c(-c2ccc(Cl)cc2)oc2ncnc(NCCN3CCCCC3)c12
InChIInChI=1S/C20H23ClN4O/c1-14-17-19(22-9-12-25-10-3-2-4-11-25)23-13-24-20(17)26-18(14)15-5-7-16(21)8-6-15/h5-8,13H,2-4,9-12H2,1H3,(H,22,23,24)
InChIKeyGBDMZSPMVVJSKY-UHFFFAOYSA-N
MW370.88 g/mol
LogP4.75
Rot. Bonds5

About 6-(4-chlorophenyl)-5-methyl-N-(2-piperidin-1-ylethyl)furo[2,3-d]pyrimidin-4-amine

6-(4-chlorophenyl)-5-methyl-N-(2-piperidin-1-ylethyl)furo[2,3-d]pyrimidin-4-amine (PubChem CID 11552448) has the molecular formula C20H23ClN4O and a molecular weight of 370.88 g/mol. Its IUPAC name is 6-(4-chlorophenyl)-5-methyl-N-(2-piperidin-1-ylethyl)furo[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-(4-chlorophenyl)-5-methyl-N-(2-piperidin-1-ylethyl)furo[2,3-d]pyrimidin-4-amine
PubChem CID11552448
Molecular FormulaC20H23ClN4O
Molecular Weight370.88 g/mol
Exact Mass370.16
IUPAC Name6-(4-chlorophenyl)-5-methyl-N-(2-piperidin-1-ylethyl)furo[2,3-d]pyrimidin-4-amine
SMILESCc1c(-c2ccc(Cl)cc2)oc2ncnc(NCCN3CCCCC3)c12
InChIInChI=1S/C20H23ClN4O/c1-14-17-19(22-9-12-25-10-3-2-4-11-25)23-13-24-20(17)26-18(14)15-5-7-16(21)8-6-15/h5-8,13H,2-4,9-12H2,1H3,(H,22,23,24)
InChIKeyGBDMZSPMVVJSKY-UHFFFAOYSA-N
XLogP4.75
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.88
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4-chlorophenyl)-5-methyl-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine
CID 11667883
N-[2-(4-ethylpiperazin-1-yl)ethyl]-5-phenyl-6-[4-(2-pyrrolidin-1-ylethoxy)phenyl]furo[2,3-d]pyrimidin-4-amine
CID 11663866
5-(4-methoxyphenyl)-6-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine
CID 58603257
5-phenyl-N-(2-piperazin-1-ylethyl)-6-[4-(2-pyrrolidin-1-ylethoxy)phenyl]furo[2,3-d]pyrimidin-4-amine
CID 11684933
4-[2-(azepan-1-yl)ethylamino]-6-chloropyrimidine-5-carbaldehyde
CID 106193990
N-[2-(azepan-1-yl)ethyl]-6-ethoxy-5-methylpyrimidin-4-amine
CID 66326640
4-N-[(4-chlorophenyl)methyl]-5-nitro-6-N-(2-piperidin-1-ylethyl)pyrimidine-4,6-diamine
CID 22526075
N-[2-(1-benzylpiperidin-4-yl)ethyl]-5-phenyl-6-[4-(2-pyrrolidin-1-ylethoxy)phenyl]furo[2,3-d]pyrimidin-4-amine;ethane
CID 143163768
5,6-bis(furan-2-yl)-N-(2-morpholin-4-ylethyl)furo[2,3-d]pyrimidin-4-amine
CID 4894519
6-N-methyl-4-N-(2-piperidin-1-ylethyl)-5-propan-2-ylpyrimidine-4,6-diamine
CID 80804448
4-chloro-N-(2-pyrrolidin-1-ylethyl)aniline
CID 62573511
N-[2-(azepan-1-yl)ethyl]-5-chloropyrimidin-2-amine
CID 79557528

Frequently Asked Questions

What is the IUPAC name of 6-(4-chlorophenyl)-5-methyl-N-(2-piperidin-1-ylethyl)furo[2,3-d]pyrimidin-4-amine?
The IUPAC name of 6-(4-chlorophenyl)-5-methyl-N-(2-piperidin-1-ylethyl)furo[2,3-d]pyrimidin-4-amine (CID 11552448) is 6-(4-chlorophenyl)-5-methyl-N-(2-piperidin-1-ylethyl)furo[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 6-(4-chlorophenyl)-5-methyl-N-(2-piperidin-1-ylethyl)furo[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 6-(4-chlorophenyl)-5-methyl-N-(2-piperidin-1-ylethyl)furo[2,3-d]pyrimidin-4-amine is Cc1c(-c2ccc(Cl)cc2)oc2ncnc(NCCN3CCCCC3)c12.
What is the InChIKey of 6-(4-chlorophenyl)-5-methyl-N-(2-piperidin-1-ylethyl)furo[2,3-d]pyrimidin-4-amine?
The InChIKey is GBDMZSPMVVJSKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN4O/c1-14-17-19(22-9-12-25-10-3-2-4-11-25)23-13-24-20(17)26-18(14)15-5-7-16(21)8-6-15/h5-8,13H,2-4,9-12H2,1H3,(H,22,23,24).
What are the key properties of 6-(4-chlorophenyl)-5-methyl-N-(2-piperidin-1-ylethyl)furo[2,3-d]pyrimidin-4-amine?
6-(4-chlorophenyl)-5-methyl-N-(2-piperidin-1-ylethyl)furo[2,3-d]pyrimidin-4-amine has a molecular weight of 370.88 g/mol, XLogP of 4.75, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chlorophenyl)-5-methyl-N-(2-piperidin-1-ylethyl)furo[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 11552448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).