2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol

C14H15N5O2 — CID 138019831

IUPAC2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol
SMILESCc1noc2ncnc(N(C)CC(O)c3cccnc3)c12
InChIInChI=1S/C14H15N5O2/c1-9-12-13(16-8-17-14(12)21-18-9)19(2)7-11(20)10-4-3-5-15-6-10/h3-6,8,11,20H,7H2,1-2H3
InChIKeyDHYVQHJRMKXFIZ-UHFFFAOYSA-N
MW285.31 g/mol
LogP1.49
Rot. Bonds4

About 2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol

2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol (PubChem CID 138019831) has the molecular formula C14H15N5O2 and a molecular weight of 285.31 g/mol. Its IUPAC name is 2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol.

Molecular Properties

Compound Name2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol
PubChem CID138019831
Molecular FormulaC14H15N5O2
Molecular Weight285.31 g/mol
Exact Mass285.12
IUPAC Name2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol
SMILESCc1noc2ncnc(N(C)CC(O)c3cccnc3)c12
InChIInChI=1S/C14H15N5O2/c1-9-12-13(16-8-17-14(12)21-18-9)19(2)7-11(20)10-4-3-5-15-6-10/h3-6,8,11,20H,7H2,1-2H3
InChIKeyDHYVQHJRMKXFIZ-UHFFFAOYSA-N
XLogP1.49
TPSA88.17 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.31
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol with MolForge

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Related Compounds

2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)-methylamino]-1-pyridin-3-ylethanol
CID 138019825
2-(dipropylamino)-1-pyridin-3-ylethanol
CID 82216469
2-(dibutylamino)-1-pyridin-3-ylethanol
CID 82216499
3-[(2-hydroxy-2-pyridin-3-ylethyl)-methylamino]propanoic acid
CID 82216497
(1R)-2-phenyl-1-pyridin-3-ylethanol
CID 93312258
(1S)-2-(methylamino)-1-pyridin-3-ylethanol
CID 10171254
2-(N-ethyl-3-methylanilino)-1-pyridin-3-ylethanol
CID 82216494
1-pyridin-3-yl-2-(2-pyridin-4-ylimidazol-1-yl)ethanol
CID 70721156
1-(6-methyl-3-pyridinyl)-2-pyridin-3-ylethanol
CID 63155414
N,N-dimethyl-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-1-pyridin-3-ylmethanamine
CID 154770051
3-methyl-N-(piperidin-4-ylmethyl)-N-propan-2-yl-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
CID 79705334
(S)-[4-(dimethylamino)phenyl]-pyridin-3-ylmethanol
CID 129369618

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol?
The IUPAC name of 2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol (CID 138019831) is 2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol.
What is the SMILES notation for 2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol?
The canonical SMILES for 2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol is Cc1noc2ncnc(N(C)CC(O)c3cccnc3)c12.
What is the InChIKey of 2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol?
The InChIKey is DHYVQHJRMKXFIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O2/c1-9-12-13(16-8-17-14(12)21-18-9)19(2)7-11(20)10-4-3-5-15-6-10/h3-6,8,11,20H,7H2,1-2H3.
What are the key properties of 2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol?
2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol has a molecular weight of 285.31 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-(3-methyl-[1,2]oxazolo[5,4-d]pyrimidin-4-yl)amino]-1-pyridin-3-ylethanol is sourced from PubChem (CID 138019831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).