N-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine

C16H28N4O — CID 133468910

IUPACN-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine
SMILESCCCCN1CCC(Nc2nccnc2OC(C)C)CC1
InChIInChI=1S/C16H28N4O/c1-4-5-10-20-11-6-14(7-12-20)19-15-16(21-13(2)3)18-9-8-17-15/h8-9,13-14H,4-7,10-12H2,1-3H3,(H,17,19)
InChIKeyXODJFQOBHNKHSA-UHFFFAOYSA-N
MW292.43 g/mol
LogP2.94
Rot. Bonds7

About N-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine

N-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine (PubChem CID 133468910) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is N-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine.

Molecular Properties

Compound NameN-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine
PubChem CID133468910
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC NameN-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine
SMILESCCCCN1CCC(Nc2nccnc2OC(C)C)CC1
InChIInChI=1S/C16H28N4O/c1-4-5-10-20-11-6-14(7-12-20)19-15-16(21-13(2)3)18-9-8-17-15/h8-9,13-14H,4-7,10-12H2,1-3H3,(H,17,19)
InChIKeyXODJFQOBHNKHSA-UHFFFAOYSA-N
XLogP2.94
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-propan-2-yloxy-N-(1-propylpiperidin-4-yl)pyridin-2-amine
CID 115923056
N-[2-(4-methylpiperidin-1-yl)ethyl]-3-propan-2-yloxypyrazin-2-amine
CID 133442218
N-[1-(4-ethylsulfonylphenyl)piperidin-4-yl]-3-propan-2-yloxypyrazin-2-amine
CID 133469107
2-[4-[[(3-propan-2-yloxypyrazin-2-yl)amino]methyl]piperidin-1-yl]ethanol
CID 133470345
1-ethyl-N-(2-propan-2-yloxy-3-pyridinyl)azepan-4-amine
CID 65073239
3-ethoxy-N-(1-methylsulfonylpiperidin-4-yl)pyrazin-2-amine
CID 87053008
3-propan-2-yloxy-N-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]pyrazin-2-amine
CID 133486690
1-butyl-N-propan-2-ylpiperidin-4-amine
CID 43748392
6-N-methyl-5-propan-2-yl-4-N-(1-propylpiperidin-4-yl)pyrimidine-4,6-diamine
CID 80783092
1-butyl-N-(3-methylbutan-2-yl)piperidin-4-amine
CID 43748354
1-butyl-N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]piperidin-4-amine
CID 119127138
1-decyl-4-propan-2-ylpiperidine
CID 166461232

Frequently Asked Questions

What is the IUPAC name of N-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine?
The IUPAC name of N-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine (CID 133468910) is N-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine.
What is the SMILES notation for N-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine?
The canonical SMILES for N-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine is CCCCN1CCC(Nc2nccnc2OC(C)C)CC1.
What is the InChIKey of N-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine?
The InChIKey is XODJFQOBHNKHSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-4-5-10-20-11-6-14(7-12-20)19-15-16(21-13(2)3)18-9-8-17-15/h8-9,13-14H,4-7,10-12H2,1-3H3,(H,17,19).
What are the key properties of N-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine?
N-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine has a molecular weight of 292.43 g/mol, XLogP of 2.94, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-butylpiperidin-4-yl)-3-propan-2-yloxypyrazin-2-amine is sourced from PubChem (CID 133468910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).