2-methyl-3-[(Z)-2-methylbut-2-enyl]pyrrolidin-1-amine

C10H20N2 — CID 146487868

IUPAC2-methyl-3-[(Z)-2-methylbut-2-enyl]pyrrolidin-1-amine
SMILESC/C=C(/C)CC1CCN(N)C1C
InChIInChI=1S/C10H20N2/c1-4-8(2)7-10-5-6-12(11)9(10)3/h4,9-10H,5-7,11H2,1-3H3/b8-4-
InChIKeyJAZKBFRWCGPXHB-YWEYNIOJSA-N
MW168.28 g/mol
LogP1.93
Rot. Bonds2

About 2-methyl-3-[(Z)-2-methylbut-2-enyl]pyrrolidin-1-amine

2-methyl-3-[(Z)-2-methylbut-2-enyl]pyrrolidin-1-amine (PubChem CID 146487868) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 2-methyl-3-[(Z)-2-methylbut-2-enyl]pyrrolidin-1-amine.

Molecular Properties

Compound Name2-methyl-3-[(Z)-2-methylbut-2-enyl]pyrrolidin-1-amine
PubChem CID146487868
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name2-methyl-3-[(Z)-2-methylbut-2-enyl]pyrrolidin-1-amine
SMILESC/C=C(/C)CC1CCN(N)C1C
InChIInChI=1S/C10H20N2/c1-4-8(2)7-10-5-6-12(11)9(10)3/h4,9-10H,5-7,11H2,1-3H3/b8-4-
InChIKeyJAZKBFRWCGPXHB-YWEYNIOJSA-N
XLogP1.93
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-[(Z)-2-methylbut-2-enyl]pyrrolidin-1-amine?
The IUPAC name of 2-methyl-3-[(Z)-2-methylbut-2-enyl]pyrrolidin-1-amine (CID 146487868) is 2-methyl-3-[(Z)-2-methylbut-2-enyl]pyrrolidin-1-amine.
What is the SMILES notation for 2-methyl-3-[(Z)-2-methylbut-2-enyl]pyrrolidin-1-amine?
The canonical SMILES for 2-methyl-3-[(Z)-2-methylbut-2-enyl]pyrrolidin-1-amine is C/C=C(/C)CC1CCN(N)C1C.
What is the InChIKey of 2-methyl-3-[(Z)-2-methylbut-2-enyl]pyrrolidin-1-amine?
The InChIKey is JAZKBFRWCGPXHB-YWEYNIOJSA-N. The full InChI is InChI=1S/C10H20N2/c1-4-8(2)7-10-5-6-12(11)9(10)3/h4,9-10H,5-7,11H2,1-3H3/b8-4-.
What are the key properties of 2-methyl-3-[(Z)-2-methylbut-2-enyl]pyrrolidin-1-amine?
2-methyl-3-[(Z)-2-methylbut-2-enyl]pyrrolidin-1-amine has a molecular weight of 168.28 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-[(Z)-2-methylbut-2-enyl]pyrrolidin-1-amine is sourced from PubChem (CID 146487868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).