(4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine

C9H17N — CID 66638941

IUPAC(4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine
SMILESC=C1C[C@H](CC(C)C)CN1
InChIInChI=1S/C9H17N/c1-7(2)4-9-5-8(3)10-6-9/h7,9-10H,3-6H2,1-2H3/t9-/m0/s1
InChIKeyGCFJGLLFSCEWOJ-VIFPVBQESA-N
MW139.24 g/mol
LogP2.16
Rot. Bonds2

About (4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine

(4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine (PubChem CID 66638941) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is (4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine.

Molecular Properties

Compound Name(4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine
PubChem CID66638941
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name(4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine
SMILESC=C1C[C@H](CC(C)C)CN1
InChIInChI=1S/C9H17N/c1-7(2)4-9-5-8(3)10-6-9/h7,9-10H,3-6H2,1-2H3/t9-/m0/s1
InChIKeyGCFJGLLFSCEWOJ-VIFPVBQESA-N
XLogP2.16
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-Methylamino-6-methylhepten
CID 23616912
3-Methyl-(methylene)pyrrolidine
CID 70311405
3-Ethyl-4-fluoro-2-methyl-5-methylidenepyrrolidine
CID 139386567
3,5-dimethyl-N-(2,2,2-trifluoroethyl)hept-1-en-2-amine
CID 143513257
2-fluoro-N',3-dimethyl-N-(3-methylbut-1-en-2-yl)hexane-1,6-diamine
CID 170040888
2,3-Bis(1-methylallyl) pyrrolidine
CID 21157860
2,2-Bis-(2-methyl-allyl)-pyrrolidine
CID 1526086
2,3-Bis(1-methylallyl)pyrrolidine
CID 5205941
2,5-Dimethylidene-3-propan-2-ylpyrrolidine
CID 20745836
1,2-Dimethyl-5-methylidene-6-azaspiro[2.4]heptane
CID 20774456
3-(2-Methylprop-2-en-1-yl)pyrrolidine
CID 53733509
5-Methyl-2-methylideneazepane
CID 53769339

Frequently Asked Questions

What is the IUPAC name of (4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine?
The IUPAC name of (4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine (CID 66638941) is (4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine.
What is the SMILES notation for (4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine?
The canonical SMILES for (4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine is C=C1C[C@H](CC(C)C)CN1.
What is the InChIKey of (4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine?
The InChIKey is GCFJGLLFSCEWOJ-VIFPVBQESA-N. The full InChI is InChI=1S/C9H17N/c1-7(2)4-9-5-8(3)10-6-9/h7,9-10H,3-6H2,1-2H3/t9-/m0/s1.
What are the key properties of (4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine?
(4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine has a molecular weight of 139.24 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-2-methylidene-4-(2-methylpropyl)pyrrolidine is sourced from PubChem (CID 66638941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).