N-(3-butoxypropyl)pyrido[2,3-b]pyrazin-6-amine

C14H20N4O — CID 115599008

IUPACN-(3-butoxypropyl)pyrido[2,3-b]pyrazin-6-amine
SMILESCCCCOCCCNc1ccc2nccnc2n1
InChIInChI=1S/C14H20N4O/c1-2-3-10-19-11-4-7-16-13-6-5-12-14(18-13)17-9-8-15-12/h5-6,8-9H,2-4,7,10-11H2,1H3,(H,16,17,18)
InChIKeyCWEXXFFRLNNHIY-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.64
Rot. Bonds8

About N-(3-butoxypropyl)pyrido[2,3-b]pyrazin-6-amine

N-(3-butoxypropyl)pyrido[2,3-b]pyrazin-6-amine (PubChem CID 115599008) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is N-(3-butoxypropyl)pyrido[2,3-b]pyrazin-6-amine.

Molecular Properties

Compound NameN-(3-butoxypropyl)pyrido[2,3-b]pyrazin-6-amine
PubChem CID115599008
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC NameN-(3-butoxypropyl)pyrido[2,3-b]pyrazin-6-amine
SMILESCCCCOCCCNc1ccc2nccnc2n1
InChIInChI=1S/C14H20N4O/c1-2-3-10-19-11-4-7-16-13-6-5-12-14(18-13)17-9-8-15-12/h5-6,8-9H,2-4,7,10-11H2,1H3,(H,16,17,18)
InChIKeyCWEXXFFRLNNHIY-UHFFFAOYSA-N
XLogP2.64
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(2-butoxyethyl)pyrido[2,3-b]pyrazin-6-amine
CID 78988496
N-(3-methylsulfanylpropyl)pyrido[2,3-b]pyrazin-6-amine
CID 78995491
N-(2-ethylsulfonylethyl)pyrido[2,3-b]pyrazin-6-amine
CID 103658809
N-(2-fluoroethyl)pyrido[2,3-b]pyrazin-6-amine
CID 130478045
N-(3-butoxypropyl)pyridin-2-amine
CID 115569614
N-(2-cycloheptyloxyethyl)pyrido[2,3-b]pyrazin-6-amine
CID 133308532
N-(2-cyclopropylethyl)pyrido[2,3-b]pyrazin-6-amine
CID 79033935
N-[(4-methylcyclohexyl)methyl]pyrido[2,3-b]pyrazin-6-amine
CID 78988476
N-(2-methylsulfonylethyl)pyrido[2,3-b]pyrazin-6-amine
CID 78955171
N-[2-[(3-methoxyphenyl)methoxy]ethyl]pyrido[2,3-b]pyrazin-6-amine
CID 133390223
N-(3-butoxypropyl)-6-nitroquinolin-2-amine
CID 78894533
N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]pyrido[2,3-b]pyrazin-6-amine
CID 133325999

Frequently Asked Questions

What is the IUPAC name of N-(3-butoxypropyl)pyrido[2,3-b]pyrazin-6-amine?
The IUPAC name of N-(3-butoxypropyl)pyrido[2,3-b]pyrazin-6-amine (CID 115599008) is N-(3-butoxypropyl)pyrido[2,3-b]pyrazin-6-amine.
What is the SMILES notation for N-(3-butoxypropyl)pyrido[2,3-b]pyrazin-6-amine?
The canonical SMILES for N-(3-butoxypropyl)pyrido[2,3-b]pyrazin-6-amine is CCCCOCCCNc1ccc2nccnc2n1.
What is the InChIKey of N-(3-butoxypropyl)pyrido[2,3-b]pyrazin-6-amine?
The InChIKey is CWEXXFFRLNNHIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-2-3-10-19-11-4-7-16-13-6-5-12-14(18-13)17-9-8-15-12/h5-6,8-9H,2-4,7,10-11H2,1H3,(H,16,17,18).
What are the key properties of N-(3-butoxypropyl)pyrido[2,3-b]pyrazin-6-amine?
N-(3-butoxypropyl)pyrido[2,3-b]pyrazin-6-amine has a molecular weight of 260.34 g/mol, XLogP of 2.64, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-butoxypropyl)pyrido[2,3-b]pyrazin-6-amine is sourced from PubChem (CID 115599008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).