(1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol

C14H18N4O2 — CID 99621227

IUPAC(1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol
SMILESCC(C)Oc1cncc(NC[C@@H](O)c2ccncc2)n1
InChIInChI=1S/C14H18N4O2/c1-10(2)20-14-9-16-8-13(18-14)17-7-12(19)11-3-5-15-6-4-11/h3-6,8-10,12,19H,7H2,1-2H3,(H,17,18)/t12-/m1/s1
InChIKeyNPGHGEKTWOIPMJ-GFCCVEGCSA-N
MW274.32 g/mol
LogP1.80
Rot. Bonds6

About (1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol

(1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol (PubChem CID 99621227) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is (1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol.

Molecular Properties

Compound Name(1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol
PubChem CID99621227
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name(1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol
SMILESCC(C)Oc1cncc(NC[C@@H](O)c2ccncc2)n1
InChIInChI=1S/C14H18N4O2/c1-10(2)20-14-9-16-8-13(18-14)17-7-12(19)11-3-5-15-6-4-11/h3-6,8-10,12,19H,7H2,1-2H3,(H,17,18)/t12-/m1/s1
InChIKeyNPGHGEKTWOIPMJ-GFCCVEGCSA-N
XLogP1.80
TPSA80.16 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze (1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol with MolForge

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Related Compounds

3-methyl-4-[(6-propan-2-yloxypyrazin-2-yl)amino]butan-1-ol
CID 133484788
3-methyl-2-[[(6-propan-2-yloxypyrazin-2-yl)amino]methyl]butanoic acid
CID 65226992
N-(2-chloro-3-methoxypropyl)-6-propan-2-yloxypyrazin-2-amine
CID 65027123
N-[2-(2-chloroethyl)pentyl]-6-propan-2-yloxypyrazin-2-amine
CID 106117265
2-[(6-ethoxypyrazin-2-yl)amino]-1-(3-methylphenyl)ethanol
CID 133375710
2-methyl-4-[(6-propan-2-yloxypyrazin-2-yl)amino]butanoic acid
CID 80539579
1-(4-tert-butylphenyl)-2-[(6-methylpyrazin-2-yl)amino]ethanol
CID 133471375
2-ethyl-1-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,2-diamine
CID 115306323
(2R)-1-[(6-phenylmethoxypyrazin-2-yl)amino]propan-2-ol
CID 97087587
2-[(6-methylpyrazin-2-yl)amino]-1-(4-phenylphenyl)ethanol
CID 133477153
ethane;2-methyl-N-(6-propan-2-yloxypyrazin-2-yl)propanamide
CID 145083687
4-methoxy-1-N-(6-propan-2-yloxypyrazin-2-yl)butane-1,3-diamine
CID 106244415

Frequently Asked Questions

What is the IUPAC name of (1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol?
The IUPAC name of (1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol (CID 99621227) is (1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol.
What is the SMILES notation for (1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol?
The canonical SMILES for (1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol is CC(C)Oc1cncc(NC[C@@H](O)c2ccncc2)n1.
What is the InChIKey of (1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol?
The InChIKey is NPGHGEKTWOIPMJ-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-10(2)20-14-9-16-8-13(18-14)17-7-12(19)11-3-5-15-6-4-11/h3-6,8-10,12,19H,7H2,1-2H3,(H,17,18)/t12-/m1/s1.
What are the key properties of (1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol?
(1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol has a molecular weight of 274.32 g/mol, XLogP of 1.80, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-2-[(6-propan-2-yloxypyrazin-2-yl)amino]-1-pyridin-4-ylethanol is sourced from PubChem (CID 99621227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).