5-methyl-1-propan-2-yl-2-pyrrolidin-3-ylimidazole;dihydrochloride

C11H21Cl2N3 — CID 146065252

IUPAC5-methyl-1-propan-2-yl-2-pyrrolidin-3-ylimidazole;dihydrochloride
SMILESCc1cnc(C2CCNC2)n1C(C)C.Cl.Cl
InChIInChI=1S/C11H19N3.2ClH/c1-8(2)14-9(3)6-13-11(14)10-4-5-12-7-10;;/h6,8,10,12H,4-5,7H2,1-3H3;2*1H
InChIKeyNPCXKIPQCIJHAO-UHFFFAOYSA-N
MW266.22 g/mol
LogP2.69
Rot. Bonds2

About 5-methyl-1-propan-2-yl-2-pyrrolidin-3-ylimidazole;dihydrochloride

5-methyl-1-propan-2-yl-2-pyrrolidin-3-ylimidazole;dihydrochloride (PubChem CID 146065252) has the molecular formula C11H21Cl2N3 and a molecular weight of 266.22 g/mol. Its IUPAC name is 5-methyl-1-propan-2-yl-2-pyrrolidin-3-ylimidazole;dihydrochloride.

Molecular Properties

Compound Name5-methyl-1-propan-2-yl-2-pyrrolidin-3-ylimidazole;dihydrochloride
PubChem CID146065252
Molecular FormulaC11H21Cl2N3
Molecular Weight266.22 g/mol
Exact Mass265.11
IUPAC Name5-methyl-1-propan-2-yl-2-pyrrolidin-3-ylimidazole;dihydrochloride
SMILESCc1cnc(C2CCNC2)n1C(C)C.Cl.Cl
InChIInChI=1S/C11H19N3.2ClH/c1-8(2)14-9(3)6-13-11(14)10-4-5-12-7-10;;/h6,8,10,12H,4-5,7H2,1-3H3;2*1H
InChIKeyNPCXKIPQCIJHAO-UHFFFAOYSA-N
XLogP2.69
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.22
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-4-propan-2-yl-5-pyrrolidin-3-yl-1,2,4-triazole
CID 63032885
1-(2-methoxyethyl)-5-methyl-2-pyrrolidin-3-ylimidazole
CID 86820584
2-cyclopropyl-5-methyl-1-[(3R)-pyrrolidin-3-yl]imidazole
CID 99728152
6-methyl-3-pyrrolidin-3-ylimidazo[1,5-a]pyridine
CID 84739755
5-chloro-2-cyclopropyl-1-propan-2-ylimidazole
CID 117259506
4-[1-(cyclopropylmethyl)-5-methylimidazol-2-yl]piperidine
CID 176515434
4-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)piperidine
CID 82494191
5-methyl-3-piperidin-3-ylimidazo[1,5-a]pyridine
CID 84740105
3-(2-cyclopropyl-5-methylimidazol-1-yl)piperidine
CID 90488108
4-methyl-3-[(3R)-pyrrolidin-3-yl]-1,2,4-triazole
CID 94917936
4-methyl-3-[(3S)-pyrrolidin-3-yl]-1,2,4-triazole
CID 94917937
3-pyrrolidin-3-ylimidazo[1,5-a]pyridin-8-ol
CID 105455282

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-propan-2-yl-2-pyrrolidin-3-ylimidazole;dihydrochloride?
The IUPAC name of 5-methyl-1-propan-2-yl-2-pyrrolidin-3-ylimidazole;dihydrochloride (CID 146065252) is 5-methyl-1-propan-2-yl-2-pyrrolidin-3-ylimidazole;dihydrochloride.
What is the SMILES notation for 5-methyl-1-propan-2-yl-2-pyrrolidin-3-ylimidazole;dihydrochloride?
The canonical SMILES for 5-methyl-1-propan-2-yl-2-pyrrolidin-3-ylimidazole;dihydrochloride is Cc1cnc(C2CCNC2)n1C(C)C.Cl.Cl.
What is the InChIKey of 5-methyl-1-propan-2-yl-2-pyrrolidin-3-ylimidazole;dihydrochloride?
The InChIKey is NPCXKIPQCIJHAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3.2ClH/c1-8(2)14-9(3)6-13-11(14)10-4-5-12-7-10;;/h6,8,10,12H,4-5,7H2,1-3H3;2*1H.
What are the key properties of 5-methyl-1-propan-2-yl-2-pyrrolidin-3-ylimidazole;dihydrochloride?
5-methyl-1-propan-2-yl-2-pyrrolidin-3-ylimidazole;dihydrochloride has a molecular weight of 266.22 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-propan-2-yl-2-pyrrolidin-3-ylimidazole;dihydrochloride is sourced from PubChem (CID 146065252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).