CID 66737893

C7H13LiNO2 — CID 66737893

IUPAC—
SMILESCCN1CCCC1C(=O)O.[Li]
InChIInChI=1S/C7H13NO2.Li/c1-2-8-5-3-4-6(8)7(9)10;/h6H,2-5H2,1H3,(H,9,10);
InChIKeyDUVPEEKLLOFGRR-UHFFFAOYSA-N
MW150.13 g/mol
LogP0.17
Rot. Bonds2

About CID 66737893

CID 66737893 (PubChem CID 66737893) has the molecular formula C7H13LiNO2 and a molecular weight of 150.13 g/mol.

Molecular Properties

Compound NameCID 66737893
PubChem CID66737893
Molecular FormulaC7H13LiNO2
Molecular Weight150.13 g/mol
Exact Mass150.11
IUPAC Name—
SMILESCCN1CCCC1C(=O)O.[Li]
InChIInChI=1S/C7H13NO2.Li/c1-2-8-5-3-4-6(8)7(9)10;/h6H,2-5H2,1H3,(H,9,10);
InChIKeyDUVPEEKLLOFGRR-UHFFFAOYSA-N
XLogP0.17
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.13
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethylpyrrolidine-2-carboxylic acid
CID 19371949
(2S)-1-(2-deuterioethyl)pyrrolidine-2-carboxylic acid
CID 142681934
(2S)-1-[(2S)-1-ethylpyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
CID 174164435
(2S)-1-propylpyrrolidine-2-carboxylic acid;hydrochloride
CID 67785488
1-(2-oxobutyl)pyrrolidine-2-carboxylic acid
CID 82406232
acetic acid;(2S)-1-ethylpyrrolidine-2-carboxamide
CID 67308625
1-(2-deuterioethyl)piperidine-2-carboxylic acid
CID 139894502
1-nonylpyrrolidine-2-carboxylic acid
CID 43441741
(2S)-N-cyclopropyl-1-ethylpyrrolidine-2-carboxamide
CID 89087707
1-pentylpyrrolidine-2-carboxylic acid;sulfane
CID 174808239
(2S)-N,1-diethylpyrrolidine-2-carboxamide;hydrochloride
CID 66936572
(2S)-1-(3-methyl-2-propan-2-ylbutyl)pyrrolidine-2-carboxylic acid
CID 122038699

Frequently Asked Questions

What is the IUPAC name of CID 66737893?
The IUPAC name of CID 66737893 (CID 66737893) is not available.
What is the SMILES notation for CID 66737893?
The canonical SMILES for CID 66737893 is CCN1CCCC1C(=O)O.[Li].
What is the InChIKey of CID 66737893?
The InChIKey is DUVPEEKLLOFGRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2.Li/c1-2-8-5-3-4-6(8)7(9)10;/h6H,2-5H2,1H3,(H,9,10);.
What are the key properties of CID 66737893?
CID 66737893 has a molecular weight of 150.13 g/mol, XLogP of 0.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 66737893 is sourced from PubChem (CID 66737893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).