1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine

C17H34N2 — CID 170586069

IUPAC1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine
SMILESCCC(C)N1CCC(N2CCC(C(C)C)CC2)CC1
InChIInChI=1S/C17H34N2/c1-5-15(4)18-12-8-17(9-13-18)19-10-6-16(7-11-19)14(2)3/h14-17H,5-13H2,1-4H3
InChIKeyDHELXOYKKYUPQI-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.62
Rot. Bonds4

About 1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine

1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine (PubChem CID 170586069) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine.

Molecular Properties

Compound Name1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine
PubChem CID170586069
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine
SMILESCCC(C)N1CCC(N2CCC(C(C)C)CC2)CC1
InChIInChI=1S/C17H34N2/c1-5-15(4)18-12-8-17(9-13-18)19-10-6-16(7-11-19)14(2)3/h14-17H,5-13H2,1-4H3
InChIKeyDHELXOYKKYUPQI-UHFFFAOYSA-N
XLogP3.62
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-butan-2-yl-4-(difluoromethyl)piperidine
CID 127988916
1-propan-2-yl-4-[[4-(4-propan-2-ylpiperidin-1-yl)piperidin-1-yl]methyl]piperidine
CID 168786072
1-butan-2-yl-N,N-dimethylpiperidin-4-amine
CID 90697678
1-butan-2-yl-4-cyclohexylpiperazine;oxalic acid
CID 17369821
(3R)-1-cyclopropyl-3-propan-2-ylpyrrolidine
CID 176871343
1-hexan-2-yl-4-propan-2-ylpiperidine
CID 67564256
3-bromo-1-butan-2-ylpyrrolidine
CID 80675941
N-propan-2-yl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine
CID 103503231
2-propan-2-yl-6-[4-(4-propan-2-ylpiperidin-1-yl)piperidin-1-yl]-2-azaspiro[3.3]heptane
CID 168786044
3-(4-butan-2-ylpiperazin-1-yl)cyclopentan-1-ol
CID 79643371
N-methyl-N-[4-(4-propan-2-ylpiperidin-1-yl)piperidin-1-yl]sulfanylhydroxylamine
CID 178004259
1-(1-benzylpiperidin-4-yl)-4-[(2R)-butan-2-yl]piperazine
CID 796148

Frequently Asked Questions

What is the IUPAC name of 1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine?
The IUPAC name of 1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine (CID 170586069) is 1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine.
What is the SMILES notation for 1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine?
The canonical SMILES for 1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine is CCC(C)N1CCC(N2CCC(C(C)C)CC2)CC1.
What is the InChIKey of 1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine?
The InChIKey is DHELXOYKKYUPQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-5-15(4)18-12-8-17(9-13-18)19-10-6-16(7-11-19)14(2)3/h14-17H,5-13H2,1-4H3.
What are the key properties of 1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine?
1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine has a molecular weight of 266.47 g/mol, XLogP of 3.62, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butan-2-yl-4-(4-propan-2-ylpiperidin-1-yl)piperidine is sourced from PubChem (CID 170586069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).