1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine

C12H23N — CID 155794244

IUPAC1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine
SMILESCC(C)(C)CC1(N2CCCC2)CC1
InChIInChI=1S/C12H23N/c1-11(2,3)10-12(6-7-12)13-8-4-5-9-13/h4-10H2,1-3H3
InChIKeyJRZUCOHNKPRVPX-UHFFFAOYSA-N
MW181.32 g/mol
LogP3.05
Rot. Bonds2

About 1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine

1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine (PubChem CID 155794244) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is 1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine.

Molecular Properties

Compound Name1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine
PubChem CID155794244
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine
SMILESCC(C)(C)CC1(N2CCCC2)CC1
InChIInChI=1S/C12H23N/c1-11(2,3)10-12(6-7-12)13-8-4-5-9-13/h4-10H2,1-3H3
InChIKeyJRZUCOHNKPRVPX-UHFFFAOYSA-N
XLogP3.05
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

8-(2,2-dimethylpropyl)spiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,1'-cyclopropane]
CID 170939588
(1-pyrrolidin-1-ylcyclopropyl)methanamine
CID 106660987
1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine
CID 155794097
8-ethyl-1,2,3,5,6,7-hexahydropyrrolizine;hydrofluoride
CID 168881533
2-(1-pyrrolidin-1-ylcyclopropyl)acetic acid
CID 83682736
1-(1,3-diethyl-3-methylcyclohexyl)pyrrolidine
CID 129273725
(1-piperidin-1-ylcycloheptyl)methanamine
CID 24703148
[1-(azepan-1-yl)cyclopentyl]methanol
CID 104549393
8-tert-butyl-1,2,3,5,6,7-hexahydropyrrolizine
CID 164798952
8a-(methoxymethyl)-2,3,5,6,7,8-hexahydro-1H-indolizine;ethane
CID 164878560
[1-(4-tert-butylpiperazin-1-yl)cyclopropyl]methanamine
CID 106661111
N-methyl-1-(1,2,3,5,6,7,8,9-octahydropyrrolo[1,2-a]azepin-9a-yl)methanamine
CID 121207930

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine?
The IUPAC name of 1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine (CID 155794244) is 1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine.
What is the SMILES notation for 1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine?
The canonical SMILES for 1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine is CC(C)(C)CC1(N2CCCC2)CC1.
What is the InChIKey of 1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine?
The InChIKey is JRZUCOHNKPRVPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-11(2,3)10-12(6-7-12)13-8-4-5-9-13/h4-10H2,1-3H3.
What are the key properties of 1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine?
1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine has a molecular weight of 181.32 g/mol, XLogP of 3.05, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine is sourced from PubChem (CID 155794244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).