(2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol

C15H26N4O — CID 95766588

IUPAC(2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol
SMILESCC[C@@H]1CN(Cc2cnc(C)cn2)CCN1C[C@@H](C)O
InChIInChI=1S/C15H26N4O/c1-4-15-11-18(5-6-19(15)9-13(3)20)10-14-8-16-12(2)7-17-14/h7-8,13,15,20H,4-6,9-11H2,1-3H3/t13-,15-/m1/s1
InChIKeyRBSVBWYRPGFAMU-UKRRQHHQSA-N
MW278.40 g/mol
LogP1.06
Rot. Bonds5

About (2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol

(2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol (PubChem CID 95766588) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is (2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol.

Molecular Properties

Compound Name(2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol
PubChem CID95766588
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name(2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol
SMILESCC[C@@H]1CN(Cc2cnc(C)cn2)CCN1C[C@@H](C)O
InChIInChI=1S/C15H26N4O/c1-4-15-11-18(5-6-19(15)9-13(3)20)10-14-8-16-12(2)7-17-14/h7-8,13,15,20H,4-6,9-11H2,1-3H3/t13-,15-/m1/s1
InChIKeyRBSVBWYRPGFAMU-UKRRQHHQSA-N
XLogP1.06
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol with MolForge

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Related Compounds

1-[4-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-2-ethylpiperazin-1-yl]propan-2-ol
CID 154747941
1-[4-[(2-amino-1,3-thiazol-5-yl)methyl]-2-ethylpiperazin-1-yl]propan-2-ol;hydrochloride
CID 120900140
(2S)-1-[(2S)-2-ethyl-4-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)piperazin-1-yl]propan-2-ol
CID 98767333
(2S)-1-[(2S)-2-ethyl-4-[(2-phenyl-1,3-oxazol-4-yl)methyl]piperazin-1-yl]propan-2-ol
CID 98767261
N-[4-[[(3R)-3-ethyl-4-[(2R)-2-hydroxypropyl]piperazin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 95978180
2-[[3-ethyl-4-(2-hydroxypropyl)piperazin-1-yl]methyl]-9-methylpyrido[1,2-a]pyrimidin-4-one
CID 71878633
1-[2-ethyl-4-[(4-methylquinazolin-2-yl)methyl]piperazin-1-yl]propan-2-ol
CID 71932952
(1S)-2-[(2R)-2-methyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]-1-phenylethanol
CID 124840043
(2R)-1-[(2R)-4-[(5-chlorothiadiazol-4-yl)methyl]-2-ethylpiperazin-1-yl]propan-2-ol
CID 95978192
3-[[3-ethyl-4-(2-hydroxypropyl)piperazin-1-yl]methyl]benzoic acid
CID 122029016
(2R)-1-[(2S)-2-ethyl-4-(2-pyridin-4-ylethyl)piperazin-1-yl]propan-2-ol
CID 97027080
(2R)-1-[(2R)-4-(1,3-benzoxazol-2-ylmethyl)-2-ethylpiperazin-1-yl]propan-2-ol
CID 95766493

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol?
The IUPAC name of (2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol (CID 95766588) is (2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol.
What is the SMILES notation for (2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol?
The canonical SMILES for (2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol is CC[C@@H]1CN(Cc2cnc(C)cn2)CCN1C[C@@H](C)O.
What is the InChIKey of (2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol?
The InChIKey is RBSVBWYRPGFAMU-UKRRQHHQSA-N. The full InChI is InChI=1S/C15H26N4O/c1-4-15-11-18(5-6-19(15)9-13(3)20)10-14-8-16-12(2)7-17-14/h7-8,13,15,20H,4-6,9-11H2,1-3H3/t13-,15-/m1/s1.
What are the key properties of (2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol?
(2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol has a molecular weight of 278.40 g/mol, XLogP of 1.06, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[(2R)-2-ethyl-4-[(5-methylpyrazin-2-yl)methyl]piperazin-1-yl]propan-2-ol is sourced from PubChem (CID 95766588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).