3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine

C12H23N5 — CID 103633778

IUPAC3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine
SMILESCC(C)N(CCNc1nccnc1N)C(C)C
InChIInChI=1S/C12H23N5/c1-9(2)17(10(3)4)8-7-16-12-11(13)14-5-6-15-12/h5-6,9-10H,7-8H2,1-4H3,(H2,13,14)(H,15,16)
InChIKeyRRHXHWZMGUACKA-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.59
Rot. Bonds6

About 3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine

3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine (PubChem CID 103633778) has the molecular formula C12H23N5 and a molecular weight of 237.35 g/mol. Its IUPAC name is 3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine.

Molecular Properties

Compound Name3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine
PubChem CID103633778
Molecular FormulaC12H23N5
Molecular Weight237.35 g/mol
Exact Mass237.20
IUPAC Name3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine
SMILESCC(C)N(CCNc1nccnc1N)C(C)C
InChIInChI=1S/C12H23N5/c1-9(2)17(10(3)4)8-7-16-12-11(13)14-5-6-15-12/h5-6,9-10H,7-8H2,1-4H3,(H2,13,14)(H,15,16)
InChIKeyRRHXHWZMGUACKA-UHFFFAOYSA-N
XLogP1.59
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[2-[di(propan-2-yl)amino]ethylamino]pyrazine-2-carbothioamide
CID 55102943
3-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2-carboxamide
CID 30480999
3-N-(2-methylbutyl)pyrazine-2,3-diamine
CID 102984244
1-[(3-aminopyrazin-2-yl)amino]-3-methylbutan-2-ol
CID 102987342
3-[2-[di(propan-2-yl)amino]ethylamino]pyridazine-4-carbonitrile
CID 80509197
3-N-but-3-ynylpyrazine-2,3-diamine
CID 103662522
2-N-[2-[di(propan-2-yl)amino]ethyl]-4-methylpyridine-2,5-diamine
CID 79173924
3-[(3-aminopyrazin-2-yl)amino]propanamide
CID 102983726
2-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyridine-3-carboxamide
CID 62073972
5-amino-6-[2-[di(propan-2-yl)amino]ethylamino]pyridine-2-carboxylic acid
CID 114404985
4-N-[2-[di(propan-2-yl)amino]ethyl]-2-N-isoquinolin-1-yl-5-methylpyrimidine-2,4-diamine
CID 117088919
4-N-[2-[di(propan-2-yl)amino]ethyl]-1H-pyrazole-4,5-diamine
CID 114988266

Frequently Asked Questions

What is the IUPAC name of 3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine?
The IUPAC name of 3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine (CID 103633778) is 3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine.
What is the SMILES notation for 3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine?
The canonical SMILES for 3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine is CC(C)N(CCNc1nccnc1N)C(C)C.
What is the InChIKey of 3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine?
The InChIKey is RRHXHWZMGUACKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N5/c1-9(2)17(10(3)4)8-7-16-12-11(13)14-5-6-15-12/h5-6,9-10H,7-8H2,1-4H3,(H2,13,14)(H,15,16).
What are the key properties of 3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine?
3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine has a molecular weight of 237.35 g/mol, XLogP of 1.59, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine is sourced from PubChem (CID 103633778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).