methane;1-(3-methylbutyl)pyrrolidine

C10H23N — CID 143832561

IUPACmethane;1-(3-methylbutyl)pyrrolidine
SMILESC.CC(C)CCN1CCCC1
InChIInChI=1S/C9H19N.CH4/c1-9(2)5-8-10-6-3-4-7-10;/h9H,3-8H2,1-2H3;1H4
InChIKeyGNXZWBYWJJIBAA-UHFFFAOYSA-N
MW157.30 g/mol
LogP2.76
Rot. Bonds3

About methane;1-(3-methylbutyl)pyrrolidine

methane;1-(3-methylbutyl)pyrrolidine (PubChem CID 143832561) has the molecular formula C10H23N and a molecular weight of 157.30 g/mol. Its IUPAC name is methane;1-(3-methylbutyl)pyrrolidine.

Molecular Properties

Compound Namemethane;1-(3-methylbutyl)pyrrolidine
PubChem CID143832561
Molecular FormulaC10H23N
Molecular Weight157.30 g/mol
Exact Mass157.18
IUPAC Namemethane;1-(3-methylbutyl)pyrrolidine
SMILESC.CC(C)CCN1CCCC1
InChIInChI=1S/C9H19N.CH4/c1-9(2)5-8-10-6-3-4-7-10;/h9H,3-8H2,1-2H3;1H4
InChIKeyGNXZWBYWJJIBAA-UHFFFAOYSA-N
XLogP2.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.30
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-iodo-4-(3-methylbutyl)piperazine
CID 166948884
3-methyl-N-(2-pyrrolidin-1-ylethyl)butan-1-amine
CID 28653628
ethane;4-(3-methylbutyl)thiomorpholine
CID 163260458
1-(3-methylsulfanylbutyl)pyrrolidine
CID 67812295
4,4-difluoro-1-(3-methylbutyl)piperidine
CID 20811830
3,3-difluoro-1-(3-methylbutyl)piperidine
CID 59748001
1-(3-methylbutyl)-N-propan-2-ylpiperidin-4-amine
CID 164928841
N,N-dimethyl-2-[4-(3-methylbutyl)piperazin-1-yl]ethanamine
CID 164595282
(2S)-1-[4-(3-methylbutyl)piperazin-1-yl]propane-2-thiol
CID 58721634
1-(3-methylbutyl)azepane-4-carbonitrile
CID 118000507
1-(3,3,7-trimethyloctyl)pyrrolidine
CID 123349263
N-[2-(azepan-1-yl)ethyl]-4-methylpentan-1-amine
CID 62575903

Frequently Asked Questions

What is the IUPAC name of methane;1-(3-methylbutyl)pyrrolidine?
The IUPAC name of methane;1-(3-methylbutyl)pyrrolidine (CID 143832561) is methane;1-(3-methylbutyl)pyrrolidine.
What is the SMILES notation for methane;1-(3-methylbutyl)pyrrolidine?
The canonical SMILES for methane;1-(3-methylbutyl)pyrrolidine is C.CC(C)CCN1CCCC1.
What is the InChIKey of methane;1-(3-methylbutyl)pyrrolidine?
The InChIKey is GNXZWBYWJJIBAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N.CH4/c1-9(2)5-8-10-6-3-4-7-10;/h9H,3-8H2,1-2H3;1H4.
What are the key properties of methane;1-(3-methylbutyl)pyrrolidine?
methane;1-(3-methylbutyl)pyrrolidine has a molecular weight of 157.30 g/mol, XLogP of 2.76, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methane;1-(3-methylbutyl)pyrrolidine is sourced from PubChem (CID 143832561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).