(2R)-2-methyl-1-[1-(1-methylcyclopropyl)ethenyl]-4-propan-2-ylpiperazine

C14H26N2 — CID 170195603

IUPAC(2R)-2-methyl-1-[1-(1-methylcyclopropyl)ethenyl]-4-propan-2-ylpiperazine
SMILESC=C(N1CCN(C(C)C)C[C@H]1C)C1(C)CC1
InChIInChI=1S/C14H26N2/c1-11(2)15-8-9-16(12(3)10-15)13(4)14(5)6-7-14/h11-12H,4,6-10H2,1-3,5H3/t12-/m1/s1
InChIKeyIWVHAXAKJTWXBZ-GFCCVEGCSA-N
MW222.38 g/mol
LogP2.71
Rot. Bonds3

About (2R)-2-methyl-1-[1-(1-methylcyclopropyl)ethenyl]-4-propan-2-ylpiperazine

(2R)-2-methyl-1-[1-(1-methylcyclopropyl)ethenyl]-4-propan-2-ylpiperazine (PubChem CID 170195603) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is (2R)-2-methyl-1-[1-(1-methylcyclopropyl)ethenyl]-4-propan-2-ylpiperazine.

Molecular Properties

Compound Name(2R)-2-methyl-1-[1-(1-methylcyclopropyl)ethenyl]-4-propan-2-ylpiperazine
PubChem CID170195603
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC Name(2R)-2-methyl-1-[1-(1-methylcyclopropyl)ethenyl]-4-propan-2-ylpiperazine
SMILESC=C(N1CCN(C(C)C)C[C@H]1C)C1(C)CC1
InChIInChI=1S/C14H26N2/c1-11(2)15-8-9-16(12(3)10-15)13(4)14(5)6-7-14/h11-12H,4,6-10H2,1-3,5H3/t12-/m1/s1
InChIKeyIWVHAXAKJTWXBZ-GFCCVEGCSA-N
XLogP2.71
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-1-[1-(1-methylcyclopropyl)ethenyl]-4-propan-2-ylpiperazine?
The IUPAC name of (2R)-2-methyl-1-[1-(1-methylcyclopropyl)ethenyl]-4-propan-2-ylpiperazine (CID 170195603) is (2R)-2-methyl-1-[1-(1-methylcyclopropyl)ethenyl]-4-propan-2-ylpiperazine.
What is the SMILES notation for (2R)-2-methyl-1-[1-(1-methylcyclopropyl)ethenyl]-4-propan-2-ylpiperazine?
The canonical SMILES for (2R)-2-methyl-1-[1-(1-methylcyclopropyl)ethenyl]-4-propan-2-ylpiperazine is C=C(N1CCN(C(C)C)C[C@H]1C)C1(C)CC1.
What is the InChIKey of (2R)-2-methyl-1-[1-(1-methylcyclopropyl)ethenyl]-4-propan-2-ylpiperazine?
The InChIKey is IWVHAXAKJTWXBZ-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H26N2/c1-11(2)15-8-9-16(12(3)10-15)13(4)14(5)6-7-14/h11-12H,4,6-10H2,1-3,5H3/t12-/m1/s1.
What are the key properties of (2R)-2-methyl-1-[1-(1-methylcyclopropyl)ethenyl]-4-propan-2-ylpiperazine?
(2R)-2-methyl-1-[1-(1-methylcyclopropyl)ethenyl]-4-propan-2-ylpiperazine has a molecular weight of 222.38 g/mol, XLogP of 2.71, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-1-[1-(1-methylcyclopropyl)ethenyl]-4-propan-2-ylpiperazine is sourced from PubChem (CID 170195603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).