(2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide

C11H15N3O3 — CID 166159062

IUPAC(2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide
SMILESC[C@@H]1CC[C@H](C(=O)Nc2cnc(CO)nc2)O1
InChIInChI=1S/C11H15N3O3/c1-7-2-3-9(17-7)11(16)14-8-4-12-10(6-15)13-5-8/h4-5,7,9,15H,2-3,6H2,1H3,(H,14,16)/t7-,9-/m1/s1
InChIKeyFHKITSLSQSBVQR-VXNVDRBHSA-N
MW237.26 g/mol
LogP0.47
Rot. Bonds3

About (2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide

(2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide (PubChem CID 166159062) has the molecular formula C11H15N3O3 and a molecular weight of 237.26 g/mol. Its IUPAC name is (2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide.

Molecular Properties

Compound Name(2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide
PubChem CID166159062
Molecular FormulaC11H15N3O3
Molecular Weight237.26 g/mol
Exact Mass237.11
IUPAC Name(2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide
SMILESC[C@@H]1CC[C@H](C(=O)Nc2cnc(CO)nc2)O1
InChIInChI=1S/C11H15N3O3/c1-7-2-3-9(17-7)11(16)14-8-4-12-10(6-15)13-5-8/h4-5,7,9,15H,2-3,6H2,1H3,(H,14,16)/t7-,9-/m1/s1
InChIKeyFHKITSLSQSBVQR-VXNVDRBHSA-N
XLogP0.47
TPSA84.34 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2R,5R)-N-[6-(hydroxymethyl)-3-pyridinyl]-5-methyloxolane-2-carboxamide
CID 166159129
N-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide
CID 81331226
(5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide
CID 167211610
N-[6-(1,2-dihydroxyethyl)-3-pyridinyl]-5-methyloxolane-2-carboxamide
CID 166158897
N-(2,3-dihydrofuro[3,2-b]pyridin-6-yl)-5-methyloxolane-2-carboxamide
CID 166160378
5-methyl-N-[6-[[(3S)-oxolan-3-yl]methyl]-3-pyridinyl]oxolane-2-carboxamide
CID 166161188
5-methyl-N-[2-(methylaminomethyl)-4-pyridinyl]oxolane-2-carboxamide
CID 166160576
2-[4-[[(2R,5R)-5-methyloxolane-2-carbonyl]amino]pyrazol-1-yl]acetic acid
CID 138002028
N-(4-bromophenyl)-5-methyloxolane-2-carboxamide
CID 80949197
N-[4-(bromomethyl)phenyl]-5-methyloxolane-2-carboxamide
CID 114310972
N-[4-ethoxy-3-(hydroxymethyl)phenyl]-5-methyloxolane-2-carboxamide
CID 81329971
N-[2-(2-fluoro-1-hydroxyethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide
CID 167211525

Frequently Asked Questions

What is the IUPAC name of (2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide?
The IUPAC name of (2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide (CID 166159062) is (2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide.
What is the SMILES notation for (2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide?
The canonical SMILES for (2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide is C[C@@H]1CC[C@H](C(=O)Nc2cnc(CO)nc2)O1.
What is the InChIKey of (2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide?
The InChIKey is FHKITSLSQSBVQR-VXNVDRBHSA-N. The full InChI is InChI=1S/C11H15N3O3/c1-7-2-3-9(17-7)11(16)14-8-4-12-10(6-15)13-5-8/h4-5,7,9,15H,2-3,6H2,1H3,(H,14,16)/t7-,9-/m1/s1.
What are the key properties of (2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide?
(2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide has a molecular weight of 237.26 g/mol, XLogP of 0.47, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5R)-N-[2-(hydroxymethyl)pyrimidin-5-yl]-5-methyloxolane-2-carboxamide is sourced from PubChem (CID 166159062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).