1-propan-2-ylpiperidine;hydrobromide

C8H18BrN — CID 44887258

IUPAC1-propan-2-ylpiperidine;hydrobromide
SMILESBr.CC(C)N1CCCCC1
InChIInChI=1S/C8H17N.BrH/c1-8(2)9-6-4-3-5-7-9;/h8H,3-7H2,1-2H3;1H
InChIKeyPVNQEYFZHDPTNJ-UHFFFAOYSA-N
MW208.14 g/mol
LogP2.46
Rot. Bonds1

About 1-propan-2-ylpiperidine;hydrobromide

1-propan-2-ylpiperidine;hydrobromide (PubChem CID 44887258) has the molecular formula C8H18BrN and a molecular weight of 208.14 g/mol. Its IUPAC name is 1-propan-2-ylpiperidine;hydrobromide.

Molecular Properties

Compound Name1-propan-2-ylpiperidine;hydrobromide
PubChem CID44887258
Molecular FormulaC8H18BrN
Molecular Weight208.14 g/mol
Exact Mass207.06
IUPAC Name1-propan-2-ylpiperidine;hydrobromide
SMILESBr.CC(C)N1CCCCC1
InChIInChI=1S/C8H17N.BrH/c1-8(2)9-6-4-3-5-7-9;/h8H,3-7H2,1-2H3;1H
InChIKeyPVNQEYFZHDPTNJ-UHFFFAOYSA-N
XLogP2.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.14
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 177140338
ethene;1-propan-2-ylpiperidine
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ethane;1-propan-2-ylpyrrolidine
CID 167557798
ethane;methane;1-propan-2-ylazetidine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 167622043
propan-2-amine;1-propan-2-ylpiperidine
CID 142245197
methoxymethane;1-propan-2-ylpiperidine
CID 153352735
methoxymethane;1-propan-2-ylazepane
CID 178173420
N,N-dimethylmethanamine;1-propan-2-ylpyrrolidine
CID 177158830
fluoroform;1-propan-2-ylpyrrolidine
CID 169177583
1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylazepane
CID 170616932
ethane;1-methylazepane;1-propan-2-ylpiperidine
CID 170601993
N,N-dimethylpropan-2-amine;methane;1-propan-2-ylpiperidine
CID 159892581

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-ylpiperidine;hydrobromide?
The IUPAC name of 1-propan-2-ylpiperidine;hydrobromide (CID 44887258) is 1-propan-2-ylpiperidine;hydrobromide.
What is the SMILES notation for 1-propan-2-ylpiperidine;hydrobromide?
The canonical SMILES for 1-propan-2-ylpiperidine;hydrobromide is Br.CC(C)N1CCCCC1.
What is the InChIKey of 1-propan-2-ylpiperidine;hydrobromide?
The InChIKey is PVNQEYFZHDPTNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.BrH/c1-8(2)9-6-4-3-5-7-9;/h8H,3-7H2,1-2H3;1H.
What are the key properties of 1-propan-2-ylpiperidine;hydrobromide?
1-propan-2-ylpiperidine;hydrobromide has a molecular weight of 208.14 g/mol, XLogP of 2.46, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-ylpiperidine;hydrobromide is sourced from PubChem (CID 44887258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).