6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine

C14H20N4OS — CID 97160147

IUPAC6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine
SMILESCOc1ncnc(N)c1CN(C)[C@H](C)Cc1ccsc1
InChIInChI=1S/C14H20N4OS/c1-10(6-11-4-5-20-8-11)18(2)7-12-13(15)16-9-17-14(12)19-3/h4-5,8-10H,6-7H2,1-3H3,(H2,15,16,17)/t10-/m1/s1
InChIKeyFIFSREKDIYYWOI-SNVBAGLBSA-N
MW292.41 g/mol
LogP2.19
Rot. Bonds6

About 6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine

6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine (PubChem CID 97160147) has the molecular formula C14H20N4OS and a molecular weight of 292.41 g/mol. Its IUPAC name is 6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine
PubChem CID97160147
Molecular FormulaC14H20N4OS
Molecular Weight292.41 g/mol
Exact Mass292.14
IUPAC Name6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine
SMILESCOc1ncnc(N)c1CN(C)[C@H](C)Cc1ccsc1
InChIInChI=1S/C14H20N4OS/c1-10(6-11-4-5-20-8-11)18(2)7-12-13(15)16-9-17-14(12)19-3/h4-5,8-10H,6-7H2,1-3H3,(H2,15,16,17)/t10-/m1/s1
InChIKeyFIFSREKDIYYWOI-SNVBAGLBSA-N
XLogP2.19
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.41
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine with MolForge

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Related Compounds

5-ethyl-4-N-methyl-4-N-(thiophen-3-ylmethyl)pyrimidine-4,6-diamine
CID 80781371
1-(3-methoxypyrazin-2-yl)-2-thiophen-3-ylethanamine
CID 105178685
N-(2,1,3-benzothiadiazol-5-ylmethyl)-N-methyl-1-thiophen-3-ylpropan-2-amine
CID 166314412
N-methyl-N-(1-thiophen-3-ylpropan-2-yl)-7H-purin-6-amine
CID 84591411
3-methoxy-1-thiophen-3-ylbutan-2-amine
CID 79616789
5-[methyl(1-thiophen-3-ylpropan-2-yl)amino]pentan-1-ol
CID 111635853
1-[methyl(1-thiophen-3-ylpropan-2-yl)amino]-3-propan-2-yloxypropan-2-ol
CID 111753828
2-methyl-3-thiophen-3-ylpropan-1-amine
CID 62505176
3-methyl-1-thiophen-3-ylbutan-2-amine
CID 61079756
5-(2-aminobutyl)-N-methyl-N-(thiophen-3-ylmethyl)pyridin-2-amine
CID 80633966
5-(1-aminoethyl)-N-methyl-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine
CID 62750166
6-chloro-5-ethyl-N-methyl-N-(thiophen-3-ylmethyl)pyrimidin-4-amine
CID 63730106

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine?
The IUPAC name of 6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine (CID 97160147) is 6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine?
The canonical SMILES for 6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine is COc1ncnc(N)c1CN(C)[C@H](C)Cc1ccsc1.
What is the InChIKey of 6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine?
The InChIKey is FIFSREKDIYYWOI-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H20N4OS/c1-10(6-11-4-5-20-8-11)18(2)7-12-13(15)16-9-17-14(12)19-3/h4-5,8-10H,6-7H2,1-3H3,(H2,15,16,17)/t10-/m1/s1.
What are the key properties of 6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine?
6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine has a molecular weight of 292.41 g/mol, XLogP of 2.19, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-5-[[methyl-[(2R)-1-thiophen-3-ylpropan-2-yl]amino]methyl]pyrimidin-4-amine is sourced from PubChem (CID 97160147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).