N,N-bis(cyclopropylmethyl)-6-(propylaminomethyl)pyrazin-2-amine

C16H26N4 — CID 66451704

IUPACN,N-bis(cyclopropylmethyl)-6-(propylaminomethyl)pyrazin-2-amine
SMILESCCCNCc1cncc(N(CC2CC2)CC2CC2)n1
InChIInChI=1S/C16H26N4/c1-2-7-17-8-15-9-18-10-16(19-15)20(11-13-3-4-13)12-14-5-6-14/h9-10,13-14,17H,2-8,11-12H2,1H3
InChIKeyAXVBTUWWNWXVQV-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.60
Rot. Bonds9

About N,N-bis(cyclopropylmethyl)-6-(propylaminomethyl)pyrazin-2-amine

N,N-bis(cyclopropylmethyl)-6-(propylaminomethyl)pyrazin-2-amine (PubChem CID 66451704) has the molecular formula C16H26N4 and a molecular weight of 274.41 g/mol. Its IUPAC name is N,N-bis(cyclopropylmethyl)-6-(propylaminomethyl)pyrazin-2-amine.

Molecular Properties

Compound NameN,N-bis(cyclopropylmethyl)-6-(propylaminomethyl)pyrazin-2-amine
PubChem CID66451704
Molecular FormulaC16H26N4
Molecular Weight274.41 g/mol
Exact Mass274.22
IUPAC NameN,N-bis(cyclopropylmethyl)-6-(propylaminomethyl)pyrazin-2-amine
SMILESCCCNCc1cncc(N(CC2CC2)CC2CC2)n1
InChIInChI=1S/C16H26N4/c1-2-7-17-8-15-9-18-10-16(19-15)20(11-13-3-4-13)12-14-5-6-14/h9-10,13-14,17H,2-8,11-12H2,1H3
InChIKeyAXVBTUWWNWXVQV-UHFFFAOYSA-N
XLogP2.60
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-[(tert-butylamino)methyl]-N-(cyclopropylmethyl)-N-propylpyrazin-2-amine
CID 66457459
N-cyclohexyl-N-ethyl-6-(propylaminomethyl)pyrazin-2-amine
CID 66458351
N-cyclopropyl-N-(cyclopropylmethyl)-6-(ethylaminomethyl)pyrazin-2-amine
CID 66451510
[6-[cyclopropylmethyl(ethyl)amino]pyrazin-2-yl]methanol
CID 66466162
2-N,2-N-bis(cyclopropylmethyl)-6-N-ethylpyrazine-2,6-diamine
CID 79033856
N-(cyclopropylmethyl)-5-(propylaminomethyl)-N-prop-2-ynylpyrazin-2-amine
CID 107380630
N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-6-(propylaminomethyl)pyrazin-2-amine
CID 66450066
6-(chloromethyl)-N-(cyclobutylmethyl)-N-ethylpyrazin-2-amine
CID 107400699
N-[[6-[4-(cyclopropylmethyl)piperazin-1-yl]pyrazin-2-yl]methyl]propan-1-amine
CID 66451855
N-cyclopropyl-N-(cyclopropylmethyl)-6-(methylaminomethyl)pyrazin-2-amine
CID 66451311
N-(3-methoxypropyl)-N-methyl-6-(propylaminomethyl)pyrazin-2-amine
CID 66450496
N-(cyclopropylmethyl)-N-ethyl-5-(propylaminomethyl)pyrimidin-4-amine
CID 114216358

Frequently Asked Questions

What is the IUPAC name of N,N-bis(cyclopropylmethyl)-6-(propylaminomethyl)pyrazin-2-amine?
The IUPAC name of N,N-bis(cyclopropylmethyl)-6-(propylaminomethyl)pyrazin-2-amine (CID 66451704) is N,N-bis(cyclopropylmethyl)-6-(propylaminomethyl)pyrazin-2-amine.
What is the SMILES notation for N,N-bis(cyclopropylmethyl)-6-(propylaminomethyl)pyrazin-2-amine?
The canonical SMILES for N,N-bis(cyclopropylmethyl)-6-(propylaminomethyl)pyrazin-2-amine is CCCNCc1cncc(N(CC2CC2)CC2CC2)n1.
What is the InChIKey of N,N-bis(cyclopropylmethyl)-6-(propylaminomethyl)pyrazin-2-amine?
The InChIKey is AXVBTUWWNWXVQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4/c1-2-7-17-8-15-9-18-10-16(19-15)20(11-13-3-4-13)12-14-5-6-14/h9-10,13-14,17H,2-8,11-12H2,1H3.
What are the key properties of N,N-bis(cyclopropylmethyl)-6-(propylaminomethyl)pyrazin-2-amine?
N,N-bis(cyclopropylmethyl)-6-(propylaminomethyl)pyrazin-2-amine has a molecular weight of 274.41 g/mol, XLogP of 2.60, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(cyclopropylmethyl)-6-(propylaminomethyl)pyrazin-2-amine is sourced from PubChem (CID 66451704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).