(4-propylphenyl)-pyrazin-2-ylmethanamine

C14H17N3 — CID 62801095

IUPAC(4-propylphenyl)-pyrazin-2-ylmethanamine
SMILESCCCc1ccc(C(N)c2cnccn2)cc1
InChIInChI=1S/C14H17N3/c1-2-3-11-4-6-12(7-5-11)14(15)13-10-16-8-9-17-13/h4-10,14H,2-3,15H2,1H3
InChIKeyWYWKSMQMQDSZLM-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.48
Rot. Bonds4

About (4-propylphenyl)-pyrazin-2-ylmethanamine

(4-propylphenyl)-pyrazin-2-ylmethanamine (PubChem CID 62801095) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is (4-propylphenyl)-pyrazin-2-ylmethanamine.

Molecular Properties

Compound Name(4-propylphenyl)-pyrazin-2-ylmethanamine
PubChem CID62801095
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name(4-propylphenyl)-pyrazin-2-ylmethanamine
SMILESCCCc1ccc(C(N)c2cnccn2)cc1
InChIInChI=1S/C14H17N3/c1-2-3-11-4-6-12(7-5-11)14(15)13-10-16-8-9-17-13/h4-10,14H,2-3,15H2,1H3
InChIKeyWYWKSMQMQDSZLM-UHFFFAOYSA-N
XLogP2.48
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-methylsulfanylphenyl)-pyrazin-2-ylmethanamine
CID 115860586
(1-methylpyrazol-3-yl)-(4-propylphenyl)methanamine
CID 65200725
[4-(difluoromethoxy)phenyl]-pyrazin-2-ylmethanamine
CID 115860590
(2-methyl-1,3-thiazol-5-yl)-(4-propylphenyl)methanamine
CID 114031639
(3-chloro-4-methylphenyl)-pyrazin-2-ylmethanamine
CID 115860386
(4-cyclobutylphenyl)-pyrazin-2-ylmethanamine
CID 116505926
(1S)-1-(4-propylphenyl)ethanamine
CID 7047688
isoquinolin-1-yl-(4-propylphenyl)methanamine
CID 63949863
N-[(4-ethylphenyl)-pyrazin-2-ylmethyl]propan-1-amine
CID 62542571
(4-propylphenyl)-quinolin-4-ylmethanamine
CID 105144415
(2-ethoxyphenyl)-pyrazin-2-ylmethanamine
CID 62801551
2-[4-(2-methylpropyl)phenyl]-2-pyrazin-2-ylethanamine
CID 116833729

Frequently Asked Questions

What is the IUPAC name of (4-propylphenyl)-pyrazin-2-ylmethanamine?
The IUPAC name of (4-propylphenyl)-pyrazin-2-ylmethanamine (CID 62801095) is (4-propylphenyl)-pyrazin-2-ylmethanamine.
What is the SMILES notation for (4-propylphenyl)-pyrazin-2-ylmethanamine?
The canonical SMILES for (4-propylphenyl)-pyrazin-2-ylmethanamine is CCCc1ccc(C(N)c2cnccn2)cc1.
What is the InChIKey of (4-propylphenyl)-pyrazin-2-ylmethanamine?
The InChIKey is WYWKSMQMQDSZLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-2-3-11-4-6-12(7-5-11)14(15)13-10-16-8-9-17-13/h4-10,14H,2-3,15H2,1H3.
What are the key properties of (4-propylphenyl)-pyrazin-2-ylmethanamine?
(4-propylphenyl)-pyrazin-2-ylmethanamine has a molecular weight of 227.31 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-propylphenyl)-pyrazin-2-ylmethanamine is sourced from PubChem (CID 62801095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).