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

C13H23N5O — CID 30480999

IUPAC3-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2-carboxamide
SMILESCC(C)N(CCNC(=O)c1nccnc1N)C(C)C
InChIInChI=1S/C13H23N5O/c1-9(2)18(10(3)4)8-7-17-13(19)11-12(14)16-6-5-15-11/h5-6,9-10H,7-8H2,1-4H3,(H2,14,16)(H,17,19)
InChIKeyFTTAIKKKRXKBON-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.91
Rot. Bonds6

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

3-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2-carboxamide (PubChem CID 30480999) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is 3-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2-carboxamide
PubChem CID30480999
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC Name3-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2-carboxamide
SMILESCC(C)N(CCNC(=O)c1nccnc1N)C(C)C
InChIInChI=1S/C13H23N5O/c1-9(2)18(10(3)4)8-7-17-13(19)11-12(14)16-6-5-15-11/h5-6,9-10H,7-8H2,1-4H3,(H2,14,16)(H,17,19)
InChIKeyFTTAIKKKRXKBON-UHFFFAOYSA-N
XLogP0.91
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyridine-3-carboxamide
CID 62073972
5-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyridine-2-carboxamide
CID 81319681
3-amino-N-hexylpyrazine-2-carboxamide
CID 32647019
3-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2,3-diamine
CID 103633778
3-amino-N'-(3-methylbutanoyl)pyrazine-2-carbohydrazide
CID 30174136
5-amino-N-[2-[di(propan-2-yl)amino]ethyl]-1H-pyrazole-4-carboxamide
CID 43159436
3-amino-N-[(2S)-5-methylhexan-2-yl]pyrazine-2-carboxamide
CID 32652897
4-amino-5-cyclopropyl-N-[2-[di(propan-2-yl)amino]ethyl]-1H-pyrazole-3-carboxamide
CID 62077444
3-amino-N-[2-[di(propan-2-yl)amino]ethyl]-2-methylbenzamide
CID 18070893
3-[2-[di(propan-2-yl)amino]ethylamino]pyrazine-2-carbothioamide
CID 55102943
3-amino-N-(1-methoxypropan-2-yl)pyrazine-2-carboxamide
CID 42940326
N-[2-[di(propan-2-yl)amino]ethyl]-5-methyl-1H-indazole-3-carboxamide
CID 78859037

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2-carboxamide?
The IUPAC name of 3-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2-carboxamide (CID 30480999) is 3-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2-carboxamide.
What is the SMILES notation for 3-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2-carboxamide?
The canonical SMILES for 3-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2-carboxamide is CC(C)N(CCNC(=O)c1nccnc1N)C(C)C.
What is the InChIKey of 3-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2-carboxamide?
The InChIKey is FTTAIKKKRXKBON-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-9(2)18(10(3)4)8-7-17-13(19)11-12(14)16-6-5-15-11/h5-6,9-10H,7-8H2,1-4H3,(H2,14,16)(H,17,19).
What are the key properties of 3-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2-carboxamide?
3-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 0.91, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-[di(propan-2-yl)amino]ethyl]pyrazine-2-carboxamide is sourced from PubChem (CID 30480999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).