1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine

C17H36N2 — CID 159983719

IUPAC1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine
SMILESCC(C)CN1CCCC1.CC(C)CN1CCCCC1
InChIInChI=1S/C9H19N.C8H17N/c1-9(2)8-10-6-4-3-5-7-10;1-8(2)7-9-5-3-4-6-9/h9H,3-8H2,1-2H3;8H,3-7H2,1-2H3
InChIKeyOGBHYFRFPVUYCQ-UHFFFAOYSA-N
MW268.49 g/mol
LogP3.87
Rot. Bonds4

About 1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine

1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine (PubChem CID 159983719) has the molecular formula C17H36N2 and a molecular weight of 268.49 g/mol. Its IUPAC name is 1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine.

Molecular Properties

Compound Name1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine
PubChem CID159983719
Molecular FormulaC17H36N2
Molecular Weight268.49 g/mol
Exact Mass268.29
IUPAC Name1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine
SMILESCC(C)CN1CCCC1.CC(C)CN1CCCCC1
InChIInChI=1S/C9H19N.C8H17N/c1-9(2)8-10-6-4-3-5-7-10;1-8(2)7-9-5-3-4-6-9/h9H,3-8H2,1-2H3;8H,3-7H2,1-2H3
InChIKeyOGBHYFRFPVUYCQ-UHFFFAOYSA-N
XLogP3.87
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.49
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

azane;1-(2-methylpropyl)pyrrolidine
CID 122583370
1-(azacyclododec-1-yl)propan-2-ol
CID 58868254
1-methyl-4-(2-methylpropyl)-1,4-diazepane
CID 58719890
[4-(2-methylpropyl)piperazin-1-yl]-piperidin-1-ylmethanone
CID 70534208
1-[1-(azacyclotetradec-1-yl)propan-2-yl]-azacyclotetradecane
CID 69225763
4-tert-butylmorpholine;1-tert-butylpiperidine;1-tert-butylpyrrolidine;1-(2-methylpropyl)piperidine
CID 167566167
1-methyl-4-(2-methylpropyl)piperazine
CID 20562082
1-(2-chloropropyl)pyrrolidine
CID 3020097
4-chloro-1-(2-methylpropyl)piperidine
CID 63389166
(3R)-1-(2-methylpropyl)azepan-3-ol
CID 171752832
(4R)-1-(2-methylpropyl)azepan-4-ol
CID 171753262
5-methyl-N-(1-piperidin-1-ylpropan-2-yl)hexan-2-amine
CID 43749079

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine?
The IUPAC name of 1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine (CID 159983719) is 1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine.
What is the SMILES notation for 1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine?
The canonical SMILES for 1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine is CC(C)CN1CCCC1.CC(C)CN1CCCCC1.
What is the InChIKey of 1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine?
The InChIKey is OGBHYFRFPVUYCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N.C8H17N/c1-9(2)8-10-6-4-3-5-7-10;1-8(2)7-9-5-3-4-6-9/h9H,3-8H2,1-2H3;8H,3-7H2,1-2H3.
What are the key properties of 1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine?
1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine has a molecular weight of 268.49 g/mol, XLogP of 3.87, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)piperidine;1-(2-methylpropyl)pyrrolidine is sourced from PubChem (CID 159983719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).