1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpyrrolidine

C16H35N3 — CID 170616803

IUPAC1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpyrrolidine
SMILESCC(C)N1CCN(C)CC1.CC1CCN(C(C)C)C1
InChIInChI=1S/C8H18N2.C8H17N/c1-8(2)10-6-4-9(3)5-7-10;1-7(2)9-5-4-8(3)6-9/h8H,4-7H2,1-3H3;7-8H,4-6H2,1-3H3
InChIKeyXWOPQWHVFNVREH-UHFFFAOYSA-N
MW269.48 g/mol
LogP2.38
Rot. Bonds2

About 1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpyrrolidine

1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpyrrolidine (PubChem CID 170616803) has the molecular formula C16H35N3 and a molecular weight of 269.48 g/mol. Its IUPAC name is 1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpyrrolidine.

Molecular Properties

Compound Name1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpyrrolidine
PubChem CID170616803
Molecular FormulaC16H35N3
Molecular Weight269.48 g/mol
Exact Mass269.28
IUPAC Name1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpyrrolidine
SMILESCC(C)N1CCN(C)CC1.CC1CCN(C(C)C)C1
InChIInChI=1S/C8H18N2.C8H17N/c1-8(2)10-6-4-9(3)5-7-10;1-7(2)9-5-4-8(3)6-9/h8H,4-7H2,1-3H3;7-8H,4-6H2,1-3H3
InChIKeyXWOPQWHVFNVREH-UHFFFAOYSA-N
XLogP2.38
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.48
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 156888189
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1-methyl-4-propan-2-ylpiperazine
CID 7471963
1-methyl-4-[1-(1-propan-2-ylpiperidin-4-yl)ethyl]piperazine
CID 170629653
(3R,6R)-3,6-dimethyl-1-propan-2-ylazepane
CID 174341942
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CID 169134554
(2R)-1,2-dimethyl-4-propan-2-ylpiperazine;(2S)-1,2-dimethyl-4-propan-2-ylpiperazine;1-methyl-4-propan-2-ylpiperazine;(2S,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2S,6S)-1,2,6-trimethyl-4-propan-2-ylpiperazine;(2R,6R)-1,2,6-trimethyl-4-propan-2-ylpiperazine
CID 158704033
formaldehyde;1-methyl-4-propan-2-ylpiperazine
CID 157498732
4-ethenyl-1-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperazine
CID 170617106
4-methyl-1-propan-2-ylpiperidine;sulfur dioxide
CID 161459747
1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylazepane
CID 170616932
(2R,7R)-1,2,7-trimethyl-4-propan-2-yl-1,4-diazepane
CID 176748171

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpyrrolidine?
The IUPAC name of 1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpyrrolidine (CID 170616803) is 1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpyrrolidine.
What is the SMILES notation for 1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpyrrolidine?
The canonical SMILES for 1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpyrrolidine is CC(C)N1CCN(C)CC1.CC1CCN(C(C)C)C1.
What is the InChIKey of 1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpyrrolidine?
The InChIKey is XWOPQWHVFNVREH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2.C8H17N/c1-8(2)10-6-4-9(3)5-7-10;1-7(2)9-5-4-8(3)6-9/h8H,4-7H2,1-3H3;7-8H,4-6H2,1-3H3.
What are the key properties of 1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpyrrolidine?
1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpyrrolidine has a molecular weight of 269.48 g/mol, XLogP of 2.38, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-propan-2-ylpiperazine;3-methyl-1-propan-2-ylpyrrolidine is sourced from PubChem (CID 170616803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).