3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carboxamide

C14H23N5O — CID 106641481

IUPAC3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carboxamide
SMILESCC(C)N(CC1CCCCN1)c1nccnc1C(N)=O
InChIInChI=1S/C14H23N5O/c1-10(2)19(9-11-5-3-4-6-16-11)14-12(13(15)20)17-7-8-18-14/h7-8,10-11,16H,3-6,9H2,1-2H3,(H2,15,20)
InChIKeyUYBNLPBACHLDNG-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.93
Rot. Bonds5

About 3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carboxamide

3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carboxamide (PubChem CID 106641481) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carboxamide
PubChem CID106641481
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carboxamide
SMILESCC(C)N(CC1CCCCN1)c1nccnc1C(N)=O
InChIInChI=1S/C14H23N5O/c1-10(2)19(9-11-5-3-4-6-16-11)14-12(13(15)20)17-7-8-18-14/h7-8,10-11,16H,3-6,9H2,1-2H3,(H2,15,20)
InChIKeyUYBNLPBACHLDNG-UHFFFAOYSA-N
XLogP0.93
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[2-methylpropyl(pyrrolidin-2-ylmethyl)amino]pyrazine-2-carboxamide
CID 106620765
3-[piperidin-2-ylmethyl(propan-2-yl)amino]-1H-pyrazin-2-one
CID 106641472
3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carbonitrile
CID 106641480
4-[piperidin-2-ylmethyl(propan-2-yl)amino]benzamide
CID 106641317
6-[piperidin-2-ylmethyl(propan-2-yl)amino]pyridine-2-carboxamide
CID 106641492
2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]pyridine-4-carboxamide
CID 106618863
N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)-1,2,4-triazin-3-amine
CID 83838459
3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyridazine-4-carbonitrile
CID 106641449
4-bromo-2-[piperidin-2-ylmethyl(propan-2-yl)amino]benzamide
CID 106641422
5-amino-4-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]-1H-pyrimidin-6-one
CID 137004380
2-methyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
CID 106641336
5-chloro-3-fluoro-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyridin-2-amine
CID 106641533

Frequently Asked Questions

What is the IUPAC name of 3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carboxamide?
The IUPAC name of 3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carboxamide (CID 106641481) is 3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carboxamide.
What is the SMILES notation for 3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carboxamide?
The canonical SMILES for 3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carboxamide is CC(C)N(CC1CCCCN1)c1nccnc1C(N)=O.
What is the InChIKey of 3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carboxamide?
The InChIKey is UYBNLPBACHLDNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-10(2)19(9-11-5-3-4-6-16-11)14-12(13(15)20)17-7-8-18-14/h7-8,10-11,16H,3-6,9H2,1-2H3,(H2,15,20).
What are the key properties of 3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carboxamide?
3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 0.93, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazine-2-carboxamide is sourced from PubChem (CID 106641481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).