N-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine

C12H14N4 — CID 60918656

IUPACN-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine
SMILESNCc1ccc(CNc2cnccn2)cc1
InChIInChI=1S/C12H14N4/c13-7-10-1-3-11(4-2-10)8-16-12-9-14-5-6-15-12/h1-6,9H,7-8,13H2,(H,15,16)
InChIKeyWIMSKYGZXRAGDU-UHFFFAOYSA-N
MW214.27 g/mol
LogP1.55
Rot. Bonds4

About N-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine

N-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine (PubChem CID 60918656) has the molecular formula C12H14N4 and a molecular weight of 214.27 g/mol. Its IUPAC name is N-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine
PubChem CID60918656
Molecular FormulaC12H14N4
Molecular Weight214.27 g/mol
Exact Mass214.12
IUPAC NameN-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine
SMILESNCc1ccc(CNc2cnccn2)cc1
InChIInChI=1S/C12H14N4/c13-7-10-1-3-11(4-2-10)8-16-12-9-14-5-6-15-12/h1-6,9H,7-8,13H2,(H,15,16)
InChIKeyWIMSKYGZXRAGDU-UHFFFAOYSA-N
XLogP1.55
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(Benzylamino)pyridine
CID 23362
2-Pyridinamine, 4-methyl-N-(phenylmethyl)-
CID 83053
Thiourea, N-(2-phenylethyl)-N'-pyrazinyl-
CID 3001117
N~3~-Benzylpyridine-2,3-diamine
CID 10397869
n-Benzylpyrazin-2-amine
CID 269234
N-(4-methylbenzyl)-2-pyrazinamine
CID 3352268
N-phenethyl-2-pyrazinamine
CID 3265909
N-[(4-chlorophenyl)methyl]pyrazin-2-amine
CID 3849617
4-[(2-Pyrazinylamino)methyl]benzenecarbonitrile
CID 4359989
1-(4-Methylphenyl)-3-pyrazin-2-ylurea
CID 12628631
1-(2-Methylphenyl)-3-pyrazin-2-ylurea
CID 17276864
Pyrazine, 2,2'-(o-chlorobenzylidenediimino)di-
CID 100764

Frequently Asked Questions

What is the IUPAC name of N-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine?
The IUPAC name of N-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine (CID 60918656) is N-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine.
What is the SMILES notation for N-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine?
The canonical SMILES for N-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine is NCc1ccc(CNc2cnccn2)cc1.
What is the InChIKey of N-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine?
The InChIKey is WIMSKYGZXRAGDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4/c13-7-10-1-3-11(4-2-10)8-16-12-9-14-5-6-15-12/h1-6,9H,7-8,13H2,(H,15,16).
What are the key properties of N-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine?
N-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine has a molecular weight of 214.27 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine is sourced from PubChem (CID 60918656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).