4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine

C14H19N5O2 — CID 154761492

IUPAC4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine
SMILESCOc1ccnc(NC[C@@H]2CCCO[C@H]2c2ccn[nH]2)n1
InChIInChI=1S/C14H19N5O2/c1-20-12-5-6-15-14(18-12)16-9-10-3-2-8-21-13(10)11-4-7-17-19-11/h4-7,10,13H,2-3,8-9H2,1H3,(H,17,19)(H,15,16,18)/t10-,13+/m0/s1
InChIKeyOFVZYSIBUNJARR-GXFFZTMASA-N
MW289.34 g/mol
LogP1.79
Rot. Bonds5

About 4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine

4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine (PubChem CID 154761492) has the molecular formula C14H19N5O2 and a molecular weight of 289.34 g/mol. Its IUPAC name is 4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine.

Molecular Properties

Compound Name4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine
PubChem CID154761492
Molecular FormulaC14H19N5O2
Molecular Weight289.34 g/mol
Exact Mass289.15
IUPAC Name4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine
SMILESCOc1ccnc(NC[C@@H]2CCCO[C@H]2c2ccn[nH]2)n1
InChIInChI=1S/C14H19N5O2/c1-20-12-5-6-15-14(18-12)16-9-10-3-2-8-21-13(10)11-4-7-17-19-11/h4-7,10,13H,2-3,8-9H2,1H3,(H,17,19)(H,15,16,18)/t10-,13+/m0/s1
InChIKeyOFVZYSIBUNJARR-GXFFZTMASA-N
XLogP1.79
TPSA84.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine with MolForge

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Related Compounds

N-(cyclopentylmethyl)-4-methoxypyrimidin-2-amine
CID 112684482
4-methoxy-N-[2-(oxolan-2-ylmethoxy)ethyl]pyrimidin-2-amine
CID 133315051
4-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methylamino]quinoline-3-carbonitrile
CID 167894156
4-methoxy-2-nitro-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]benzenesulfonamide
CID 154801237
N-[(3-methyl-4-pyridinyl)methyl]-1-[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methanamine
CID 154761610
4-methoxy-N-[(3-methylcyclopentyl)methyl]pyrimidin-2-amine
CID 107413823
4-methoxy-N-(thiolan-2-ylmethyl)pyrimidin-2-amine
CID 112698618
N-[[2-(aminomethyl)cyclohexyl]methyl]-4-propan-2-yloxypyrimidin-2-amine
CID 115975730
N-[(2-aminocyclopentyl)methyl]-4-ethoxypyrimidin-2-amine
CID 112639496
N-[[2-(chloromethyl)cyclohexyl]methyl]-4-propan-2-yloxypyrimidin-2-amine
CID 115975697
4-methoxy-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]pyrimidine
CID 51104275
N-[(2-chlorocyclopentyl)methyl]-4-ethoxypyrimidin-2-amine
CID 112639314

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine?
The IUPAC name of 4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine (CID 154761492) is 4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine.
What is the SMILES notation for 4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine?
The canonical SMILES for 4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine is COc1ccnc(NC[C@@H]2CCCO[C@H]2c2ccn[nH]2)n1.
What is the InChIKey of 4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine?
The InChIKey is OFVZYSIBUNJARR-GXFFZTMASA-N. The full InChI is InChI=1S/C14H19N5O2/c1-20-12-5-6-15-14(18-12)16-9-10-3-2-8-21-13(10)11-4-7-17-19-11/h4-7,10,13H,2-3,8-9H2,1H3,(H,17,19)(H,15,16,18)/t10-,13+/m0/s1.
What are the key properties of 4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine?
4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine has a molecular weight of 289.34 g/mol, XLogP of 1.79, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[[(2R,3S)-2-(1H-pyrazol-5-yl)oxan-3-yl]methyl]pyrimidin-2-amine is sourced from PubChem (CID 154761492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).