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

C16H26N4O — CID 115307539

IUPACN-(cyclopropylmethyl)-1-(6-propan-2-yloxypyrazin-2-yl)piperidin-4-amine
SMILESCC(C)Oc1cncc(N2CCC(NCC3CC3)CC2)n1
InChIInChI=1S/C16H26N4O/c1-12(2)21-16-11-17-10-15(19-16)20-7-5-14(6-8-20)18-9-13-3-4-13/h10-14,18H,3-9H2,1-2H3
InChIKeyGURDASBLQZJQHI-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.23
Rot. Bonds6

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

N-(cyclopropylmethyl)-1-(6-propan-2-yloxypyrazin-2-yl)piperidin-4-amine (PubChem CID 115307539) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-1-(6-propan-2-yloxypyrazin-2-yl)piperidin-4-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-1-(6-propan-2-yloxypyrazin-2-yl)piperidin-4-amine
PubChem CID115307539
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC NameN-(cyclopropylmethyl)-1-(6-propan-2-yloxypyrazin-2-yl)piperidin-4-amine
SMILESCC(C)Oc1cncc(N2CCC(NCC3CC3)CC2)n1
InChIInChI=1S/C16H26N4O/c1-12(2)21-16-11-17-10-15(19-16)20-7-5-14(6-8-20)18-9-13-3-4-13/h10-14,18H,3-9H2,1-2H3
InChIKeyGURDASBLQZJQHI-UHFFFAOYSA-N
XLogP2.23
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(cyclopropylmethyl)-1-(6-methoxypyrazin-2-yl)piperidin-4-amine
CID 115307442
N-(cyclopropylmethyl)-1-(6-ethoxypyrazin-2-yl)piperidin-4-amine
CID 115307461
N-(cyclopropylmethyl)-1-(5,6-dimethylpyrazin-2-yl)piperidin-4-amine
CID 114476593
2-[3-(methoxymethyl)piperidin-1-yl]-6-propan-2-yloxypyrazine
CID 86797731
(1S,5R)-8-methyl-3-[4-(6-propan-2-yloxypyrazin-2-yl)piperazin-1-yl]-8-azabicyclo[3.2.1]octane
CID 99622770
2-methyl-N-[(3R)-1-(6-propan-2-yloxypyrazin-2-yl)piperidin-3-yl]propanamide
CID 99600977
2-propan-2-yloxy-6-[4-(1,1,1-trifluoropropan-2-yl)piperazin-1-yl]pyrazine
CID 133485480
5-(6-propan-2-yloxypyrazin-2-yl)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
CID 66213195
N-[(1-pyrazin-2-ylpiperidin-4-yl)methyl]cyclopropanamine
CID 62592661
2-methyl-1-(6-propan-2-yloxypyrazin-2-yl)piperidin-4-amine
CID 113284672
(1S,3S)-3-ethoxy-7-(6-propan-2-yloxypyrazin-2-yl)-7-azaspiro[3.5]nonan-1-ol
CID 99610577
(1S,3R)-3-ethoxy-7-(6-propan-2-yloxypyrazin-2-yl)-7-azaspiro[3.5]nonan-1-ol
CID 99610576

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-1-(6-propan-2-yloxypyrazin-2-yl)piperidin-4-amine?
The IUPAC name of N-(cyclopropylmethyl)-1-(6-propan-2-yloxypyrazin-2-yl)piperidin-4-amine (CID 115307539) is N-(cyclopropylmethyl)-1-(6-propan-2-yloxypyrazin-2-yl)piperidin-4-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-1-(6-propan-2-yloxypyrazin-2-yl)piperidin-4-amine?
The canonical SMILES for N-(cyclopropylmethyl)-1-(6-propan-2-yloxypyrazin-2-yl)piperidin-4-amine is CC(C)Oc1cncc(N2CCC(NCC3CC3)CC2)n1.
What is the InChIKey of N-(cyclopropylmethyl)-1-(6-propan-2-yloxypyrazin-2-yl)piperidin-4-amine?
The InChIKey is GURDASBLQZJQHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-12(2)21-16-11-17-10-15(19-16)20-7-5-14(6-8-20)18-9-13-3-4-13/h10-14,18H,3-9H2,1-2H3.
What are the key properties of N-(cyclopropylmethyl)-1-(6-propan-2-yloxypyrazin-2-yl)piperidin-4-amine?
N-(cyclopropylmethyl)-1-(6-propan-2-yloxypyrazin-2-yl)piperidin-4-amine has a molecular weight of 290.41 g/mol, XLogP of 2.23, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-1-(6-propan-2-yloxypyrazin-2-yl)piperidin-4-amine is sourced from PubChem (CID 115307539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).