[1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol

C15H22N4OS — CID 103329347

IUPAC[1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol
SMILESCCCNc1nc(NCC2(CO)CC2)c2cc(C)sc2n1
InChIInChI=1S/C15H22N4OS/c1-3-6-16-14-18-12(17-8-15(9-20)4-5-15)11-7-10(2)21-13(11)19-14/h7,20H,3-6,8-9H2,1-2H3,(H2,16,17,18,19)
InChIKeyGHBINMZDEYIDJS-UHFFFAOYSA-N
MW306.44 g/mol
LogP3.01
Rot. Bonds7

About [1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol

[1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol (PubChem CID 103329347) has the molecular formula C15H22N4OS and a molecular weight of 306.44 g/mol. Its IUPAC name is [1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol
PubChem CID103329347
Molecular FormulaC15H22N4OS
Molecular Weight306.44 g/mol
Exact Mass306.15
IUPAC Name[1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol
SMILESCCCNc1nc(NCC2(CO)CC2)c2cc(C)sc2n1
InChIInChI=1S/C15H22N4OS/c1-3-6-16-14-18-12(17-8-15(9-20)4-5-15)11-7-10(2)21-13(11)19-14/h7,20H,3-6,8-9H2,1-2H3,(H2,16,17,18,19)
InChIKeyGHBINMZDEYIDJS-UHFFFAOYSA-N
XLogP3.01
TPSA70.07 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.44
LogP ≤ 53.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze [1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol with MolForge

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Related Compounds

[1-[[(2-chloro-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]methyl]cyclopropyl]methanol
CID 103322245
3-[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]propan-1-ol
CID 103324486
2-[1-[[(2-hydrazinyl-6-methylthieno[2,3-d]pyrimidin-4-yl)amino]methyl]cyclopropyl]ethanol
CID 103335861
[1-[[[6-ethyl-2-(ethylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol
CID 103329341
2-methyl-2-[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]propan-1-ol
CID 103324837
6-methyl-4-N-(3-methyloxolan-3-yl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103330123
2-[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]propan-1-ol
CID 103324859
2-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324046
6-methyl-4-N-(2-methylsulfanylethyl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103328024
1-[[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclobutan-1-ol
CID 103330490
2-hydroxy-3-[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]propanamide
CID 106178963
4-N-(2-ethoxyethyl)-6-methyl-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103325198

Frequently Asked Questions

What is the IUPAC name of [1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol?
The IUPAC name of [1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol (CID 103329347) is [1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol is CCCNc1nc(NCC2(CO)CC2)c2cc(C)sc2n1.
What is the InChIKey of [1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol?
The InChIKey is GHBINMZDEYIDJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4OS/c1-3-6-16-14-18-12(17-8-15(9-20)4-5-15)11-7-10(2)21-13(11)19-14/h7,20H,3-6,8-9H2,1-2H3,(H2,16,17,18,19).
What are the key properties of [1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol?
[1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol has a molecular weight of 306.44 g/mol, XLogP of 3.01, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol is sourced from PubChem (CID 103329347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).