1,3-diethylpyrrolidine;ethane

C10H23N — CID 145103245

IUPAC1,3-diethylpyrrolidine;ethane
SMILESCC.CCC1CCN(CC)C1
InChIInChI=1S/C8H17N.C2H6/c1-3-8-5-6-9(4-2)7-8;1-2/h8H,3-7H2,1-2H3;1-2H3
InChIKeySVIJDPKHYCRRCW-UHFFFAOYSA-N
MW157.30 g/mol
LogP2.76
Rot. Bonds2

About 1,3-diethylpyrrolidine;ethane

1,3-diethylpyrrolidine;ethane (PubChem CID 145103245) has the molecular formula C10H23N and a molecular weight of 157.30 g/mol. Its IUPAC name is 1,3-diethylpyrrolidine;ethane.

Molecular Properties

Compound Name1,3-diethylpyrrolidine;ethane
PubChem CID145103245
Molecular FormulaC10H23N
Molecular Weight157.30 g/mol
Exact Mass157.18
IUPAC Name1,3-diethylpyrrolidine;ethane
SMILESCC.CCC1CCN(CC)C1
InChIInChI=1S/C8H17N.C2H6/c1-3-8-5-6-9(4-2)7-8;1-2/h8H,3-7H2,1-2H3;1-2H3
InChIKeySVIJDPKHYCRRCW-UHFFFAOYSA-N
XLogP2.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.30
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,3-diethylpyrrolidine;ethane;molecular hydrogen
CID 143628979
1,3-diethylpyrrolidine;formonitrile
CID 175874911
1,4-diethylpiperidine;ethane
CID 143709904
(3-ethylpyrrolidin-1-yl)methanamine
CID 57317446
1-ethyl-3-propylpyrrolidine;hydrochloride
CID 175849509
1-(2,2-difluoroethyl)-3-ethylpyrrolidine;ethane
CID 169182399
1,4-diethylazepane
CID 67522864
(3S)-1-ethylpyrrolidin-3-amine
CID 10678211
ethane;1-ethyl-3-methylpyrrolidine
CID 90936593
1,4-diethylpiperidine;1-ethyl-4-methylpiperazine
CID 143157970
1-(1-ethylpyrrolidin-3-yl)propan-2-one
CID 91527917
3-(3-ethylpyrrolidin-1-yl)propan-1-ol
CID 67281983

Frequently Asked Questions

What is the IUPAC name of 1,3-diethylpyrrolidine;ethane?
The IUPAC name of 1,3-diethylpyrrolidine;ethane (CID 145103245) is 1,3-diethylpyrrolidine;ethane.
What is the SMILES notation for 1,3-diethylpyrrolidine;ethane?
The canonical SMILES for 1,3-diethylpyrrolidine;ethane is CC.CCC1CCN(CC)C1.
What is the InChIKey of 1,3-diethylpyrrolidine;ethane?
The InChIKey is SVIJDPKHYCRRCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N.C2H6/c1-3-8-5-6-9(4-2)7-8;1-2/h8H,3-7H2,1-2H3;1-2H3.
What are the key properties of 1,3-diethylpyrrolidine;ethane?
1,3-diethylpyrrolidine;ethane has a molecular weight of 157.30 g/mol, XLogP of 2.76, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-diethylpyrrolidine;ethane is sourced from PubChem (CID 145103245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).