N,4,4-trimethyl-1-pyrazin-2-ylpentan-1-amine

C12H21N3 — CID 62601001

IUPACN,4,4-trimethyl-1-pyrazin-2-ylpentan-1-amine
SMILESCNC(CCC(C)(C)C)c1cnccn1
InChIInChI=1S/C12H21N3/c1-12(2,3)6-5-10(13-4)11-9-14-7-8-15-11/h7-10,13H,5-6H2,1-4H3
InChIKeyDWESLBKBVRGBIL-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.56
Rot. Bonds4

About N,4,4-trimethyl-1-pyrazin-2-ylpentan-1-amine

N,4,4-trimethyl-1-pyrazin-2-ylpentan-1-amine (PubChem CID 62601001) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is N,4,4-trimethyl-1-pyrazin-2-ylpentan-1-amine.

Molecular Properties

Compound NameN,4,4-trimethyl-1-pyrazin-2-ylpentan-1-amine
PubChem CID62601001
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC NameN,4,4-trimethyl-1-pyrazin-2-ylpentan-1-amine
SMILESCNC(CCC(C)(C)C)c1cnccn1
InChIInChI=1S/C12H21N3/c1-12(2,3)6-5-10(13-4)11-9-14-7-8-15-11/h7-10,13H,5-6H2,1-4H3
InChIKeyDWESLBKBVRGBIL-UHFFFAOYSA-N
XLogP2.56
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-Methylpentyl)pyrazine
CID 57339820
2-Methyl-2-(pyrazin-2-yl)butan-1-amine
CID 83695027
2,5-Pyrazinedipentanamine
CID 3804270
2-(1-Piperazin-1-ylpiperidin-2-yl)pyrazine
CID 118038184
3-cyclopropyl-N-(1-pyrazin-2-ylethyl)cyclohexan-1-amine
CID 75482982
(3S,4S,6S)-4-fluoro-6-(5-methylpyrazin-2-yl)piperidin-3-amine
CID 167387456
3,3,3-trifluoro-N-methyl-1-pyrazin-2-ylpropan-1-amine
CID 63969647
N-ethyl-3,3,3-trifluoro-1-pyrazin-2-ylpropan-1-amine
CID 63969648
3,3,3-trifluoro-N-propyl-1-pyrazin-2-ylpropan-1-amine
CID 63969649
N-(1-pyrazin-2-ylethyl)-4-(trifluoromethyl)cyclohexan-1-amine
CID 64190271
N-(1-pyrazin-2-ylethyl)-2-(trifluoromethyl)cyclohexan-1-amine
CID 64190476
N-(1-pyrazin-2-ylethyl)-3-(trifluoromethyl)cyclohexan-1-amine
CID 64191516

Frequently Asked Questions

What is the IUPAC name of N,4,4-trimethyl-1-pyrazin-2-ylpentan-1-amine?
The IUPAC name of N,4,4-trimethyl-1-pyrazin-2-ylpentan-1-amine (CID 62601001) is N,4,4-trimethyl-1-pyrazin-2-ylpentan-1-amine.
What is the SMILES notation for N,4,4-trimethyl-1-pyrazin-2-ylpentan-1-amine?
The canonical SMILES for N,4,4-trimethyl-1-pyrazin-2-ylpentan-1-amine is CNC(CCC(C)(C)C)c1cnccn1.
What is the InChIKey of N,4,4-trimethyl-1-pyrazin-2-ylpentan-1-amine?
The InChIKey is DWESLBKBVRGBIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-12(2,3)6-5-10(13-4)11-9-14-7-8-15-11/h7-10,13H,5-6H2,1-4H3.
What are the key properties of N,4,4-trimethyl-1-pyrazin-2-ylpentan-1-amine?
N,4,4-trimethyl-1-pyrazin-2-ylpentan-1-amine has a molecular weight of 207.32 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4,4-trimethyl-1-pyrazin-2-ylpentan-1-amine is sourced from PubChem (CID 62601001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).