5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine

C13H20N6 — CID 107379754

IUPAC5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine
SMILESCCNCc1cnc(N(C)Cc2cnn(C)c2)cn1
InChIInChI=1S/C13H20N6/c1-4-14-6-12-7-16-13(8-15-12)18(2)9-11-5-17-19(3)10-11/h5,7-8,10,14H,4,6,9H2,1-3H3
InChIKeyQSRQHTPTERWODP-UHFFFAOYSA-N
MW260.35 g/mol
LogP0.96
Rot. Bonds6

About 5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine

5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine (PubChem CID 107379754) has the molecular formula C13H20N6 and a molecular weight of 260.35 g/mol. Its IUPAC name is 5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine.

Molecular Properties

Compound Name5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine
PubChem CID107379754
Molecular FormulaC13H20N6
Molecular Weight260.35 g/mol
Exact Mass260.17
IUPAC Name5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine
SMILESCCNCc1cnc(N(C)Cc2cnn(C)c2)cn1
InChIInChI=1S/C13H20N6/c1-4-14-6-12-7-16-13(8-15-12)18(2)9-11-5-17-19(3)10-11/h5,7-8,10,14H,4,6,9H2,1-3H3
InChIKeyQSRQHTPTERWODP-UHFFFAOYSA-N
XLogP0.96
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.35
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-5-(propylaminomethyl)pyrazin-2-amine
CID 107379755
[6-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-2-pyridinyl]methanol
CID 62254806
5-(ethylaminomethyl)-4-(methoxymethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine
CID 107510180
N-[(2-bromophenyl)methyl]-5-(ethylaminomethyl)-N-methylpyrazin-2-amine
CID 107379580
6-[(cyclopropylamino)methyl]-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine
CID 66451248
N,N-diethyl-5-(ethylaminomethyl)pyrazin-2-amine
CID 107378823
[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-4-pyridinyl]methanol
CID 61442010
6-N-methyl-6-N-[(1-methylpyrazol-4-yl)methyl]pyridine-2,3,6-triamine
CID 79827181
1-N-ethyl-3-N-methyl-3-N-[(1-methylpyrazol-4-yl)methyl]butane-1,3-diamine
CID 62463522
6-chloro-2-ethyl-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine
CID 80936080
N-[[6-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]-2-pyridinyl]methyl]propan-1-amine
CID 106906373
N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-4-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62289751

Frequently Asked Questions

What is the IUPAC name of 5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine?
The IUPAC name of 5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine (CID 107379754) is 5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine.
What is the SMILES notation for 5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine?
The canonical SMILES for 5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine is CCNCc1cnc(N(C)Cc2cnn(C)c2)cn1.
What is the InChIKey of 5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine?
The InChIKey is QSRQHTPTERWODP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N6/c1-4-14-6-12-7-16-13(8-15-12)18(2)9-11-5-17-19(3)10-11/h5,7-8,10,14H,4,6,9H2,1-3H3.
What are the key properties of 5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine?
5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine has a molecular weight of 260.35 g/mol, XLogP of 0.96, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylaminomethyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine is sourced from PubChem (CID 107379754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).