N-methyl-5-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)pyrazin-2-amine

C15H22N4S — CID 107379415

IUPACN-methyl-5-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)pyrazin-2-amine
SMILESCC(C)NCc1cnc(N(C)C(C)c2cccs2)cn1
InChIInChI=1S/C15H22N4S/c1-11(2)16-8-13-9-18-15(10-17-13)19(4)12(3)14-6-5-7-20-14/h5-7,9-12,16H,8H2,1-4H3
InChIKeyMWVSPVSYKFXIKZ-UHFFFAOYSA-N
MW290.44 g/mol
LogP3.23
Rot. Bonds6

About N-methyl-5-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)pyrazin-2-amine

N-methyl-5-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)pyrazin-2-amine (PubChem CID 107379415) has the molecular formula C15H22N4S and a molecular weight of 290.44 g/mol. Its IUPAC name is N-methyl-5-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)pyrazin-2-amine.

Molecular Properties

Compound NameN-methyl-5-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)pyrazin-2-amine
PubChem CID107379415
Molecular FormulaC15H22N4S
Molecular Weight290.44 g/mol
Exact Mass290.16
IUPAC NameN-methyl-5-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)pyrazin-2-amine
SMILESCC(C)NCc1cnc(N(C)C(C)c2cccs2)cn1
InChIInChI=1S/C15H22N4S/c1-11(2)16-8-13-9-18-15(10-17-13)19(4)12(3)14-6-5-7-20-14/h5-7,9-12,16H,8H2,1-4H3
InChIKeyMWVSPVSYKFXIKZ-UHFFFAOYSA-N
XLogP3.23
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.44
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-N-(3-methylbutan-2-yl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine
CID 107379212
6-(ethylaminomethyl)-N-methyl-N-(1-thiophen-2-ylethyl)pyrazin-2-amine
CID 66456842
5-chloro-4-[(cyclopropylamino)methyl]-N-methyl-N-(1-thiophen-2-ylethyl)pyridin-2-amine
CID 114925792
6-(aminomethyl)-N-methyl-N-(1-thiophen-2-ylethyl)pyridazin-3-amine
CID 62286701
4-(aminomethyl)-N-methyl-N-(1-thiophen-2-ylethyl)pyridin-2-amine
CID 54980987
4-chloro-N-methyl-2-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)aniline
CID 114849487
N,N-bis(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine
CID 107379342
N-cyclopentyl-N-methyl-5-[(propan-2-ylamino)methyl]pyrazin-2-amine
CID 107379057
2-(ethylaminomethyl)-N-methyl-N-(1-thiophen-2-ylethyl)pyridin-4-amine
CID 55059591
N-methyl-5-[(propan-2-ylamino)methyl]-N-(pyridin-3-ylmethyl)pyrazin-2-amine
CID 107379230
5-[(cyclopropylamino)methyl]-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyrazin-2-amine
CID 107380520
N-methyl-4-[(2-methylpropylamino)methyl]-N-(1-thiophen-2-ylethyl)pyridin-2-amine
CID 62281991

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)pyrazin-2-amine?
The IUPAC name of N-methyl-5-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)pyrazin-2-amine (CID 107379415) is N-methyl-5-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)pyrazin-2-amine.
What is the SMILES notation for N-methyl-5-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)pyrazin-2-amine?
The canonical SMILES for N-methyl-5-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)pyrazin-2-amine is CC(C)NCc1cnc(N(C)C(C)c2cccs2)cn1.
What is the InChIKey of N-methyl-5-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)pyrazin-2-amine?
The InChIKey is MWVSPVSYKFXIKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4S/c1-11(2)16-8-13-9-18-15(10-17-13)19(4)12(3)14-6-5-7-20-14/h5-7,9-12,16H,8H2,1-4H3.
What are the key properties of N-methyl-5-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)pyrazin-2-amine?
N-methyl-5-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)pyrazin-2-amine has a molecular weight of 290.44 g/mol, XLogP of 3.23, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-[(propan-2-ylamino)methyl]-N-(1-thiophen-2-ylethyl)pyrazin-2-amine is sourced from PubChem (CID 107379415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).