(2-propan-2-ylpyrrolidin-2-yl)methanol

C8H17NO — CID 84648893

IUPAC(2-propan-2-ylpyrrolidin-2-yl)methanol
SMILESCC(C)C1(CO)CCCN1
InChIInChI=1S/C8H17NO/c1-7(2)8(6-10)4-3-5-9-8/h7,9-10H,3-6H2,1-2H3
InChIKeyFHSMPVFRCQSFCH-UHFFFAOYSA-N
MW143.23 g/mol
LogP0.76
Rot. Bonds2

About (2-propan-2-ylpyrrolidin-2-yl)methanol

(2-propan-2-ylpyrrolidin-2-yl)methanol (PubChem CID 84648893) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (2-propan-2-ylpyrrolidin-2-yl)methanol.

Molecular Properties

Compound Name(2-propan-2-ylpyrrolidin-2-yl)methanol
PubChem CID84648893
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(2-propan-2-ylpyrrolidin-2-yl)methanol
SMILESCC(C)C1(CO)CCCN1
InChIInChI=1S/C8H17NO/c1-7(2)8(6-10)4-3-5-9-8/h7,9-10H,3-6H2,1-2H3
InChIKeyFHSMPVFRCQSFCH-UHFFFAOYSA-N
XLogP0.76
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-dimethyl-1-(2-propan-2-ylpyrrolidin-2-yl)methanamine
CID 117271095
2-(2-ethylbutyl)-2-propan-2-ylpyrrolidine
CID 82922353
2-ethyl-2-propan-2-ylazepane
CID 79117006
2-benzyl-2-propan-2-ylpyrrolidine
CID 66466509
2-dodecyl-2-propan-2-ylpyrrolidine
CID 66468316
2-(2-methylpropyl)-2-propan-2-ylazepane
CID 79119427
[2-(hydroxymethyl)pyrrolidin-2-yl]-λ2-stannane
CID 175519982
[(2R)-2-methylpyrrolidin-2-yl]methanol
CID 51656383
2-propan-2-yl-2-(3,3,3-trifluoropropyl)azepane
CID 79117029
2-propan-2-yl-2-(propan-2-yloxymethyl)azepane
CID 79569057
2-(2-methoxyethyl)-2-propan-2-ylpiperidine
CID 117271109
2-pentyl-2-propan-2-ylazepane
CID 79119110

Frequently Asked Questions

What is the IUPAC name of (2-propan-2-ylpyrrolidin-2-yl)methanol?
The IUPAC name of (2-propan-2-ylpyrrolidin-2-yl)methanol (CID 84648893) is (2-propan-2-ylpyrrolidin-2-yl)methanol.
What is the SMILES notation for (2-propan-2-ylpyrrolidin-2-yl)methanol?
The canonical SMILES for (2-propan-2-ylpyrrolidin-2-yl)methanol is CC(C)C1(CO)CCCN1.
What is the InChIKey of (2-propan-2-ylpyrrolidin-2-yl)methanol?
The InChIKey is FHSMPVFRCQSFCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-7(2)8(6-10)4-3-5-9-8/h7,9-10H,3-6H2,1-2H3.
What are the key properties of (2-propan-2-ylpyrrolidin-2-yl)methanol?
(2-propan-2-ylpyrrolidin-2-yl)methanol has a molecular weight of 143.23 g/mol, XLogP of 0.76, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-propan-2-ylpyrrolidin-2-yl)methanol is sourced from PubChem (CID 84648893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).