1-decyl-4-pyrrolidin-2-ylpiperidine

C19H38N2 — CID 63404665

IUPAC1-decyl-4-pyrrolidin-2-ylpiperidine
SMILESCCCCCCCCCCN1CCC(C2CCCN2)CC1
InChIInChI=1S/C19H38N2/c1-2-3-4-5-6-7-8-9-15-21-16-12-18(13-17-21)19-11-10-14-20-19/h18-20H,2-17H2,1H3
InChIKeyNFSPYBNEENLCFH-UHFFFAOYSA-N
MW294.53 g/mol
LogP4.59
Rot. Bonds10

About 1-decyl-4-pyrrolidin-2-ylpiperidine

1-decyl-4-pyrrolidin-2-ylpiperidine (PubChem CID 63404665) has the molecular formula C19H38N2 and a molecular weight of 294.53 g/mol. Its IUPAC name is 1-decyl-4-pyrrolidin-2-ylpiperidine.

Molecular Properties

Compound Name1-decyl-4-pyrrolidin-2-ylpiperidine
PubChem CID63404665
Molecular FormulaC19H38N2
Molecular Weight294.53 g/mol
Exact Mass294.30
IUPAC Name1-decyl-4-pyrrolidin-2-ylpiperidine
SMILESCCCCCCCCCCN1CCC(C2CCCN2)CC1
InChIInChI=1S/C19H38N2/c1-2-3-4-5-6-7-8-9-15-21-16-12-18(13-17-21)19-11-10-14-20-19/h18-20H,2-17H2,1H3
InChIKeyNFSPYBNEENLCFH-UHFFFAOYSA-N
XLogP4.59
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.53
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-pentyl-4-pyrrolidin-2-ylpiperidine
CID 63255578
1-(2-piperidin-1-ylethyl)-4-pyrrolidin-2-ylpiperidine
CID 63259095
1-(4-pyrrolidin-2-ylpiperidin-1-yl)hexan-1-one
CID 63259335
3-cyclopropyl-1-octylpiperazine
CID 64833415
(3aS,6aS)-5-pentyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole
CID 64851796
N-butyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)acetamide
CID 63259352
1-(4-methoxybutyl)-3-pyrrolidin-2-ylpiperidine
CID 112703556
1-but-3-ynyl-4-pyrrolidin-2-ylpiperidine
CID 63259701
6-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2,3,4,4a,5,7,8,8a-octahydro-1H-1,6-naphthyridine
CID 104563880
1-[(1-butyltetrazol-5-yl)methyl]-4-pyrrolidin-2-ylpiperidine
CID 63257489
1-(2-tert-butylsulfonylethyl)-4-pyrrolidin-2-ylpiperidine
CID 106727944
(3aS,6aS)-5-butyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[2,3-c]pyrrole
CID 64850440

Frequently Asked Questions

What is the IUPAC name of 1-decyl-4-pyrrolidin-2-ylpiperidine?
The IUPAC name of 1-decyl-4-pyrrolidin-2-ylpiperidine (CID 63404665) is 1-decyl-4-pyrrolidin-2-ylpiperidine.
What is the SMILES notation for 1-decyl-4-pyrrolidin-2-ylpiperidine?
The canonical SMILES for 1-decyl-4-pyrrolidin-2-ylpiperidine is CCCCCCCCCCN1CCC(C2CCCN2)CC1.
What is the InChIKey of 1-decyl-4-pyrrolidin-2-ylpiperidine?
The InChIKey is NFSPYBNEENLCFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38N2/c1-2-3-4-5-6-7-8-9-15-21-16-12-18(13-17-21)19-11-10-14-20-19/h18-20H,2-17H2,1H3.
What are the key properties of 1-decyl-4-pyrrolidin-2-ylpiperidine?
1-decyl-4-pyrrolidin-2-ylpiperidine has a molecular weight of 294.53 g/mol, XLogP of 4.59, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-decyl-4-pyrrolidin-2-ylpiperidine is sourced from PubChem (CID 63404665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).