N-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine

C14H22N4O — CID 115307442

IUPACN-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine
SMILESCOc1cncc(N2CCC(NCC3CC3)CC2)n1
InChIInChI=1S/C14H22N4O/c1-19-14-10-15-9-13(17-14)18-6-4-12(5-7-18)16-8-11-2-3-11/h9-12,16H,2-8H2,1H3
InChIKeyNWIRMIRFHKSGBM-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.45
Rot. Bonds5

About N-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine

N-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine (PubChem CID 115307442) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine
PubChem CID115307442
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC NameN-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine
SMILESCOc1cncc(N2CCC(NCC3CC3)CC2)n1
InChIInChI=1S/C14H22N4O/c1-19-14-10-15-9-13(17-14)18-6-4-12(5-7-18)16-8-11-2-3-11/h9-12,16H,2-8H2,1H3
InChIKeyNWIRMIRFHKSGBM-UHFFFAOYSA-N
XLogP1.45
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine?
The IUPAC name of N-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine (CID 115307442) is N-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine?
The canonical SMILES for N-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine is COc1cncc(N2CCC(NCC3CC3)CC2)n1.
What is the InChIKey of N-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine?
The InChIKey is NWIRMIRFHKSGBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-19-14-10-15-9-13(17-14)18-6-4-12(5-7-18)16-8-11-2-3-11/h9-12,16H,2-8H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine?
N-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine has a molecular weight of 262.36 g/mol, XLogP of 1.45, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine is sourced from PubChem (CID 115307442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).