4-chloro-N,N-dimethyl-6-propylthieno[2,3-d]pyrimidin-2-amine

C11H14ClN3S — CID 82309241

IUPAC4-chloro-N,N-dimethyl-6-propylthieno[2,3-d]pyrimidin-2-amine
SMILESCCCc1cc2c(Cl)nc(N(C)C)nc2s1
InChIInChI=1S/C11H14ClN3S/c1-4-5-7-6-8-9(12)13-11(15(2)3)14-10(8)16-7/h6H,4-5H2,1-3H3
InChIKeyCNAYCEXBBUGBRK-UHFFFAOYSA-N
MW255.77 g/mol
LogP3.36
Rot. Bonds3

About 4-chloro-N,N-dimethyl-6-propylthieno[2,3-d]pyrimidin-2-amine

4-chloro-N,N-dimethyl-6-propylthieno[2,3-d]pyrimidin-2-amine (PubChem CID 82309241) has the molecular formula C11H14ClN3S and a molecular weight of 255.77 g/mol. Its IUPAC name is 4-chloro-N,N-dimethyl-6-propylthieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name4-chloro-N,N-dimethyl-6-propylthieno[2,3-d]pyrimidin-2-amine
PubChem CID82309241
Molecular FormulaC11H14ClN3S
Molecular Weight255.77 g/mol
Exact Mass255.06
IUPAC Name4-chloro-N,N-dimethyl-6-propylthieno[2,3-d]pyrimidin-2-amine
SMILESCCCc1cc2c(Cl)nc(N(C)C)nc2s1
InChIInChI=1S/C11H14ClN3S/c1-4-5-7-6-8-9(12)13-11(15(2)3)14-10(8)16-7/h6H,4-5H2,1-3H3
InChIKeyCNAYCEXBBUGBRK-UHFFFAOYSA-N
XLogP3.36
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.77
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-6-ethyl-N,N-dipropylthieno[2,3-d]pyrimidin-2-amine
CID 82309139
4-chloro-2-(4-ethylpiperazin-1-yl)-6-propylthieno[2,3-d]pyrimidine
CID 82309158
N-butyl-4-chloro-N,6-dimethylthieno[2,3-d]pyrimidin-2-amine
CID 82309246
2-(4-chloro-6-propylthieno[2,3-d]pyrimidin-2-yl)-N-prop-2-enylprop-2-en-1-amine
CID 95506871
4-chloro-2-(2,5-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidine
CID 63663426
4,9,15,20-tetrapropyl-3,10,14,21-tetrathiahexacyclo[10.10.0.02,6.07,11.013,17.018,22]docosa-1,4,6,8,11,13(17),15,18(22),19-nonaene
CID 177402898
2-chloro-5-propyl-1,3-thiazole
CID 56625607
2-chloro-6-ethyl-N,N-bis(trideuteriomethyl)thieno[2,3-d]pyrimidin-4-amine
CID 169436107
4-chloro-6-ethyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidine
CID 65144576
N'-methyl-N'-[6-propyl-4-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]thieno[2,3-d]pyrimidin-2-yl]ethane-1,2-diamine
CID 58333828
2-(2-bromo-3,4-difluorophenyl)-4-chloro-6-ethylthieno[2,3-d]pyrimidine
CID 107532954
N'-(2-chloro-6-ethylthieno[2,3-d]pyrimidin-4-yl)-N,N-dimethyl-N'-propylethane-1,2-diamine
CID 103321374

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N,N-dimethyl-6-propylthieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 4-chloro-N,N-dimethyl-6-propylthieno[2,3-d]pyrimidin-2-amine (CID 82309241) is 4-chloro-N,N-dimethyl-6-propylthieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 4-chloro-N,N-dimethyl-6-propylthieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 4-chloro-N,N-dimethyl-6-propylthieno[2,3-d]pyrimidin-2-amine is CCCc1cc2c(Cl)nc(N(C)C)nc2s1.
What is the InChIKey of 4-chloro-N,N-dimethyl-6-propylthieno[2,3-d]pyrimidin-2-amine?
The InChIKey is CNAYCEXBBUGBRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3S/c1-4-5-7-6-8-9(12)13-11(15(2)3)14-10(8)16-7/h6H,4-5H2,1-3H3.
What are the key properties of 4-chloro-N,N-dimethyl-6-propylthieno[2,3-d]pyrimidin-2-amine?
4-chloro-N,N-dimethyl-6-propylthieno[2,3-d]pyrimidin-2-amine has a molecular weight of 255.77 g/mol, XLogP of 3.36, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N,N-dimethyl-6-propylthieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 82309241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).