2-propan-2-ylpyrrolidine;hydrochloride

C7H16ClN — CID 17389515

IUPAC2-propan-2-ylpyrrolidine;hydrochloride
SMILESCC(C)C1CCCN1.Cl
InChIInChI=1S/C7H15N.ClH/c1-6(2)7-4-3-5-8-7;/h6-8H,3-5H2,1-2H3;1H
InChIKeyCDMWOCOXYGUROI-UHFFFAOYSA-N
MW149.66 g/mol
LogP1.82
Rot. Bonds1

About 2-propan-2-ylpyrrolidine;hydrochloride

2-propan-2-ylpyrrolidine;hydrochloride (PubChem CID 17389515) has the molecular formula C7H16ClN and a molecular weight of 149.66 g/mol. Its IUPAC name is 2-propan-2-ylpyrrolidine;hydrochloride.

Molecular Properties

Compound Name2-propan-2-ylpyrrolidine;hydrochloride
PubChem CID17389515
Molecular FormulaC7H16ClN
Molecular Weight149.66 g/mol
Exact Mass149.10
IUPAC Name2-propan-2-ylpyrrolidine;hydrochloride
SMILESCC(C)C1CCCN1.Cl
InChIInChI=1S/C7H15N.ClH/c1-6(2)7-4-3-5-8-7;/h6-8H,3-5H2,1-2H3;1H
InChIKeyCDMWOCOXYGUROI-UHFFFAOYSA-N
XLogP1.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.66
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,2,5-Trimethylpyrrolidine
CID 21572701
2-(2-Methylpropyl)pyrrolidine
CID 3613277
2,2,4-Trimethylpyrrolidine
CID 414770
N-Isopropyl-6-methyl-2-heptylamine hydrochloride
CID 19916
(S)-2,2,4-trimethylpyrrolidine hydrochloride
CID 121250814
3-Propylpyrrolidine
CID 12648198
2-(Propan-2-yl)pyrrolidine
CID 3855943
(2R,5R)-2,5-dimethylpyrrolidine hydrochloride
CID 12268509
2-Sec-butylpyrrolidine
CID 3563411
2,4-Dimethylpyrrolidine
CID 10887841
Pyrrolidine, 2,4-dimethyl-, cis-
CID 23279028
3-Butylpyrrolidine
CID 17389761

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-ylpyrrolidine;hydrochloride?
The IUPAC name of 2-propan-2-ylpyrrolidine;hydrochloride (CID 17389515) is 2-propan-2-ylpyrrolidine;hydrochloride.
What is the SMILES notation for 2-propan-2-ylpyrrolidine;hydrochloride?
The canonical SMILES for 2-propan-2-ylpyrrolidine;hydrochloride is CC(C)C1CCCN1.Cl.
What is the InChIKey of 2-propan-2-ylpyrrolidine;hydrochloride?
The InChIKey is CDMWOCOXYGUROI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N.ClH/c1-6(2)7-4-3-5-8-7;/h6-8H,3-5H2,1-2H3;1H.
What are the key properties of 2-propan-2-ylpyrrolidine;hydrochloride?
2-propan-2-ylpyrrolidine;hydrochloride has a molecular weight of 149.66 g/mol, XLogP of 1.82, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-ylpyrrolidine;hydrochloride is sourced from PubChem (CID 17389515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).