1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine

C14H28N2 — CID 60978804

IUPAC1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine
SMILESCC(C)C(C)N1CCCC(C2CCCN2)C1
InChIInChI=1S/C14H28N2/c1-11(2)12(3)16-9-5-6-13(10-16)14-7-4-8-15-14/h11-15H,4-10H2,1-3H3
InChIKeyRVKBRXDCICPMFX-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.49
Rot. Bonds3

About 1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine

1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine (PubChem CID 60978804) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine.

Molecular Properties

Compound Name1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine
PubChem CID60978804
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine
SMILESCC(C)C(C)N1CCCC(C2CCCN2)C1
InChIInChI=1S/C14H28N2/c1-11(2)12(3)16-9-5-6-13(10-16)14-7-4-8-15-14/h11-15H,4-10H2,1-3H3
InChIKeyRVKBRXDCICPMFX-UHFFFAOYSA-N
XLogP2.49
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[1-(2,6-difluorophenyl)ethyl]-3-pyrrolidin-2-ylpiperidine
CID 60978666
1-[1-(2-methoxyphenyl)ethyl]-3-pyrrolidin-2-ylpiperidine
CID 60978163
1-(4-methylpentyl)-3-pyrrolidin-2-ylpiperidine
CID 83158375
(4aR,8aR)-6-(3-methylbutyl)-2,3,4,4a,5,7,8,8a-octahydro-1H-1,6-naphthyridine
CID 118759759
(4aS,7aS)-6-butan-2-yl-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 102678881
1-[1-(3-chloro-4-fluorophenyl)ethyl]-3-pyrrolidin-2-ylpiperidine
CID 60979360
1-(2-propan-2-yloxyethyl)-3-pyrrolidin-2-ylpiperidine
CID 54957761
2-methyl-3-(4-pyrrolidin-2-ylpiperidin-1-yl)butanoic acid
CID 79414419
3-cyclohexyl-1-(3-methylpentan-2-yl)-1,4-diazepane
CID 64944397
1-(1-methylpyrrolidin-3-yl)-3-pyrrolidin-2-ylpiperidine
CID 62977717
1-(3,3-dimethylbutyl)-3-pyrrolidin-2-ylpiperidine
CID 54885429
N-methyl-3-pyrrolidin-2-ylpiperidine-1-sulfonamide
CID 114810564

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine?
The IUPAC name of 1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine (CID 60978804) is 1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine.
What is the SMILES notation for 1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine?
The canonical SMILES for 1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine is CC(C)C(C)N1CCCC(C2CCCN2)C1.
What is the InChIKey of 1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine?
The InChIKey is RVKBRXDCICPMFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-11(2)12(3)16-9-5-6-13(10-16)14-7-4-8-15-14/h11-15H,4-10H2,1-3H3.
What are the key properties of 1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine?
1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine has a molecular weight of 224.39 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylbutan-2-yl)-3-pyrrolidin-2-ylpiperidine is sourced from PubChem (CID 60978804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).