(2S)-1,2-di(propan-2-yl)pyrrolidine

C10H21N — CID 59966007

IUPAC(2S)-1,2-di(propan-2-yl)pyrrolidine
SMILESCC(C)[C@@H]1CCCN1C(C)C
InChIInChI=1S/C10H21N/c1-8(2)10-6-5-7-11(10)9(3)4/h8-10H,5-7H2,1-4H3/t10-/m0/s1
InChIKeyFJGKREXPPCDOSE-JTQLQIEISA-N
MW155.28 g/mol
LogP2.52
Rot. Bonds2

About (2S)-1,2-di(propan-2-yl)pyrrolidine

(2S)-1,2-di(propan-2-yl)pyrrolidine (PubChem CID 59966007) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is (2S)-1,2-di(propan-2-yl)pyrrolidine.

Molecular Properties

Compound Name(2S)-1,2-di(propan-2-yl)pyrrolidine
PubChem CID59966007
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name(2S)-1,2-di(propan-2-yl)pyrrolidine
SMILESCC(C)[C@@H]1CCCN1C(C)C
InChIInChI=1S/C10H21N/c1-8(2)10-6-5-7-11(10)9(3)4/h8-10H,5-7H2,1-4H3/t10-/m0/s1
InChIKeyFJGKREXPPCDOSE-JTQLQIEISA-N
XLogP2.52
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-1,2-di(propan-2-yl)pyrrolidine
CID 59965991
1,2-di(propan-2-yl)azocane
CID 134605032
1,2,5-tri(propan-2-yl)azepane
CID 176801550
(7R)-N,1,7-tri(propan-2-yl)azepan-4-amine
CID 152916334
3,4-di(propan-2-yl)-1,4-oxazepane
CID 123714088
1,2,4-tri(propan-2-yl)piperazine
CID 58977477
1-cyclopentyl-2-propan-2-ylpyrrolidine
CID 91035341
2-methyl-N-propan-2-yl-3-(2-propan-2-ylpyrrolidin-1-yl)butan-1-amine
CID 79408560
2-(1-bromopropan-2-yl)-1-propan-2-ylpiperidine
CID 164645144
1-methanidyl-2-propan-2-ylpyrrolidine
CID 72524813
4-methyl-1,2-di(propan-2-yl)piperidine
CID 141078246
2-pentan-2-yl-1-propan-2-ylpiperidine
CID 135193938

Frequently Asked Questions

What is the IUPAC name of (2S)-1,2-di(propan-2-yl)pyrrolidine?
The IUPAC name of (2S)-1,2-di(propan-2-yl)pyrrolidine (CID 59966007) is (2S)-1,2-di(propan-2-yl)pyrrolidine.
What is the SMILES notation for (2S)-1,2-di(propan-2-yl)pyrrolidine?
The canonical SMILES for (2S)-1,2-di(propan-2-yl)pyrrolidine is CC(C)[C@@H]1CCCN1C(C)C.
What is the InChIKey of (2S)-1,2-di(propan-2-yl)pyrrolidine?
The InChIKey is FJGKREXPPCDOSE-JTQLQIEISA-N. The full InChI is InChI=1S/C10H21N/c1-8(2)10-6-5-7-11(10)9(3)4/h8-10H,5-7H2,1-4H3/t10-/m0/s1.
What are the key properties of (2S)-1,2-di(propan-2-yl)pyrrolidine?
(2S)-1,2-di(propan-2-yl)pyrrolidine has a molecular weight of 155.28 g/mol, XLogP of 2.52, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1,2-di(propan-2-yl)pyrrolidine is sourced from PubChem (CID 59966007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).