N-butan-2-yl-6-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine

C14H26N4 — CID 66456793

IUPACN-butan-2-yl-6-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine
SMILESCCC(C)N(C)c1cncc(CNC(C)(C)C)n1
InChIInChI=1S/C14H26N4/c1-7-11(2)18(6)13-10-15-8-12(17-13)9-16-14(3,4)5/h8,10-11,16H,7,9H2,1-6H3
InChIKeyVLULBQJMAADTPA-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.60
Rot. Bonds5

About N-butan-2-yl-6-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine

N-butan-2-yl-6-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine (PubChem CID 66456793) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is N-butan-2-yl-6-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine.

Molecular Properties

Compound NameN-butan-2-yl-6-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine
PubChem CID66456793
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC NameN-butan-2-yl-6-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine
SMILESCCC(C)N(C)c1cncc(CNC(C)(C)C)n1
InChIInChI=1S/C14H26N4/c1-7-11(2)18(6)13-10-15-8-12(17-13)9-16-14(3,4)5/h8,10-11,16H,7,9H2,1-6H3
InChIKeyVLULBQJMAADTPA-UHFFFAOYSA-N
XLogP2.60
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(tert-butylamino)methyl]-N-(1-methoxypropan-2-yl)-N-methylpyrazin-2-amine
CID 66456847
6-[(tert-butylamino)methyl]-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyrazin-2-amine
CID 115987694
6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine
CID 66451243
6-[(tert-butylamino)methyl]-N-(2-methylpropyl)-N-propan-2-ylpyrazin-2-amine
CID 66449687
6-[(tert-butylamino)methyl]-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrazin-2-amine
CID 66458019
6-[(tert-butylamino)methyl]-N-cycloheptyl-N-methylpyrazin-2-amine
CID 66457221
6-[(tert-butylamino)methyl]-N-ethyl-N-(2-methylprop-2-enyl)pyrazin-2-amine
CID 66457774
6-[(tert-butylamino)methyl]-N-(cyclobutylmethyl)-N-methylpyrazin-2-amine
CID 66450490
6-[(tert-butylamino)methyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrazin-2-amine
CID 66455660
6-[(tert-butylamino)methyl]-N-(cyclopropylmethyl)-N-propylpyrazin-2-amine
CID 66457459
N-butan-2-yl-4-[(tert-butylamino)methyl]-N-methylpyridin-2-amine
CID 62279317
5-[(tert-butylamino)methyl]-N-methyl-N-propan-2-ylpyrazin-2-amine
CID 107378934

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-6-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine?
The IUPAC name of N-butan-2-yl-6-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine (CID 66456793) is N-butan-2-yl-6-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine.
What is the SMILES notation for N-butan-2-yl-6-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine?
The canonical SMILES for N-butan-2-yl-6-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine is CCC(C)N(C)c1cncc(CNC(C)(C)C)n1.
What is the InChIKey of N-butan-2-yl-6-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine?
The InChIKey is VLULBQJMAADTPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-7-11(2)18(6)13-10-15-8-12(17-13)9-16-14(3,4)5/h8,10-11,16H,7,9H2,1-6H3.
What are the key properties of N-butan-2-yl-6-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine?
N-butan-2-yl-6-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine has a molecular weight of 250.39 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-6-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine is sourced from PubChem (CID 66456793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).