N-ethyl-N-(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine

C14H26N4 — CID 107379098

IUPACN-ethyl-N-(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine
SMILESCCN(CC(C)C)c1cnc(CNC(C)C)cn1
InChIInChI=1S/C14H26N4/c1-6-18(10-11(2)3)14-9-16-13(8-17-14)7-15-12(4)5/h8-9,11-12,15H,6-7,10H2,1-5H3
InChIKeyCAJJOJQNUJZECR-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.46
Rot. Bonds7

About N-ethyl-N-(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine

N-ethyl-N-(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine (PubChem CID 107379098) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is N-ethyl-N-(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-ethyl-N-(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine
PubChem CID107379098
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC NameN-ethyl-N-(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine
SMILESCCN(CC(C)C)c1cnc(CNC(C)C)cn1
InChIInChI=1S/C14H26N4/c1-6-18(10-11(2)3)14-9-16-13(8-17-14)7-15-12(4)5/h8-9,11-12,15H,6-7,10H2,1-5H3
InChIKeyCAJJOJQNUJZECR-UHFFFAOYSA-N
XLogP2.46
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-bis(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine
CID 107379342
N-ethyl-N-(2-ethylbutyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine
CID 107379566
N-ethyl-5-[(propan-2-ylamino)methyl]-N-propylpyrazin-2-amine
CID 107379089
N-ethyl-N-(furan-2-ylmethyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine
CID 107379760
N-methyl-N-(3-methylbutan-2-yl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine
CID 107379212
N,N-diethyl-5-(ethylaminomethyl)pyrazin-2-amine
CID 107378823
N-cyclopentyl-N-methyl-5-[(propan-2-ylamino)methyl]pyrazin-2-amine
CID 107379057
5-(methylaminomethyl)-N,N-bis(3-methylbutyl)pyrazin-2-amine
CID 107871217
5-chloro-N-ethyl-N-(2-methylpropyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62280062
5-bromo-N-ethyl-N-(2-methylpropyl)-3-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62279366
5-chloro-N-ethyl-N-(2-methylpropyl)-4-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 114925419
5-chloro-N-ethyl-N-(2-methylpropyl)-4-(propylaminomethyl)pyridin-2-amine
CID 114925412

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine?
The IUPAC name of N-ethyl-N-(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine (CID 107379098) is N-ethyl-N-(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine.
What is the SMILES notation for N-ethyl-N-(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine?
The canonical SMILES for N-ethyl-N-(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine is CCN(CC(C)C)c1cnc(CNC(C)C)cn1.
What is the InChIKey of N-ethyl-N-(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine?
The InChIKey is CAJJOJQNUJZECR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-6-18(10-11(2)3)14-9-16-13(8-17-14)7-15-12(4)5/h8-9,11-12,15H,6-7,10H2,1-5H3.
What are the key properties of N-ethyl-N-(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine?
N-ethyl-N-(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine has a molecular weight of 250.39 g/mol, XLogP of 2.46, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-methylpropyl)-5-[(propan-2-ylamino)methyl]pyrazin-2-amine is sourced from PubChem (CID 107379098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).