N-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine

C14H26N4 — CID 107378904

IUPACN-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine
SMILESCCCCN(C)c1cnc(CNC(C)(C)C)cn1
InChIInChI=1S/C14H26N4/c1-6-7-8-18(5)13-11-15-12(9-16-13)10-17-14(2,3)4/h9,11,17H,6-8,10H2,1-5H3
InChIKeyWWXFOHUSPSFLIP-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.60
Rot. Bonds6

About N-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine

N-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine (PubChem CID 107378904) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is N-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine.

Molecular Properties

Compound NameN-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine
PubChem CID107378904
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC NameN-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine
SMILESCCCCN(C)c1cnc(CNC(C)(C)C)cn1
InChIInChI=1S/C14H26N4/c1-6-7-8-18(5)13-11-15-12(9-16-13)10-17-14(2,3)4/h9,11,17H,6-8,10H2,1-5H3
InChIKeyWWXFOHUSPSFLIP-UHFFFAOYSA-N
XLogP2.60
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
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

5-[(tert-butylamino)methyl]-N-methyl-N-propan-2-ylpyrazin-2-amine
CID 107378934
5-[(tert-butylamino)methyl]-N-methyl-N-(oxan-4-ylmethyl)pyrazin-2-amine
CID 107380315
5-[(tert-butylamino)methyl]-N-methyl-N-[(2-methylfuran-3-yl)methyl]pyrazin-2-amine
CID 107379866
2-N-methyl-2-N-pentylpyrazine-2,5-diamine
CID 80653265
N-[[5-(2-butoxyethoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine
CID 107381495
5-[(tert-butylamino)methyl]-N-ethyl-N-(1-methoxypropan-2-yl)pyrazin-2-amine
CID 107379397
N-butyl-4-[(tert-butylamino)methyl]-2-chloro-N-methylaniline
CID 81149131
6-[(tert-butylamino)methyl]-N-methyl-N-(3-methylbutyl)pyrazin-2-amine
CID 66451243
N-ethyl-5-(ethylaminomethyl)-N-methylpyrazin-2-amine
CID 107379070
N-butyl-N-ethyl-5-(propylaminomethyl)pyrazin-2-amine
CID 107378913
N-butyl-N-methyl-5-(propylaminomethyl)pyridin-2-amine
CID 62285989
N-methyl-5-(methylaminomethyl)-N-(3-methylbutyl)pyrazin-2-amine
CID 107379708

Frequently Asked Questions

What is the IUPAC name of N-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine?
The IUPAC name of N-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine (CID 107378904) is N-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine.
What is the SMILES notation for N-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine?
The canonical SMILES for N-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine is CCCCN(C)c1cnc(CNC(C)(C)C)cn1.
What is the InChIKey of N-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine?
The InChIKey is WWXFOHUSPSFLIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-6-7-8-18(5)13-11-15-12(9-16-13)10-17-14(2,3)4/h9,11,17H,6-8,10H2,1-5H3.
What are the key properties of N-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine?
N-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine has a molecular weight of 250.39 g/mol, XLogP of 2.60, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-5-[(tert-butylamino)methyl]-N-methylpyrazin-2-amine is sourced from PubChem (CID 107378904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).