1-(1-but-1-en-2-ylcyclopropyl)-N,N-dimethylmethanamine

C10H19N — CID 142835958

IUPAC1-(1-but-1-en-2-ylcyclopropyl)-N,N-dimethylmethanamine
SMILESC=C(CC)C1(CN(C)C)CC1
InChIInChI=1S/C10H19N/c1-5-9(2)10(6-7-10)8-11(3)4/h2,5-8H2,1,3-4H3
InChIKeyDMSYRWFPFDSGTL-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.29
Rot. Bonds4

About 1-(1-but-1-en-2-ylcyclopropyl)-N,N-dimethylmethanamine

1-(1-but-1-en-2-ylcyclopropyl)-N,N-dimethylmethanamine (PubChem CID 142835958) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 1-(1-but-1-en-2-ylcyclopropyl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(1-but-1-en-2-ylcyclopropyl)-N,N-dimethylmethanamine
PubChem CID142835958
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name1-(1-but-1-en-2-ylcyclopropyl)-N,N-dimethylmethanamine
SMILESC=C(CC)C1(CN(C)C)CC1
InChIInChI=1S/C10H19N/c1-5-9(2)10(6-7-10)8-11(3)4/h2,5-8H2,1,3-4H3
InChIKeyDMSYRWFPFDSGTL-UHFFFAOYSA-N
XLogP2.29
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(1-but-1-en-2-ylcyclopropyl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(1-but-1-en-2-ylcyclopropyl)-N,N-dimethylmethanamine (CID 142835958) is 1-(1-but-1-en-2-ylcyclopropyl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(1-but-1-en-2-ylcyclopropyl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(1-but-1-en-2-ylcyclopropyl)-N,N-dimethylmethanamine is C=C(CC)C1(CN(C)C)CC1.
What is the InChIKey of 1-(1-but-1-en-2-ylcyclopropyl)-N,N-dimethylmethanamine?
The InChIKey is DMSYRWFPFDSGTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-5-9(2)10(6-7-10)8-11(3)4/h2,5-8H2,1,3-4H3.
What are the key properties of 1-(1-but-1-en-2-ylcyclopropyl)-N,N-dimethylmethanamine?
1-(1-but-1-en-2-ylcyclopropyl)-N,N-dimethylmethanamine has a molecular weight of 153.27 g/mol, XLogP of 2.29, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-but-1-en-2-ylcyclopropyl)-N,N-dimethylmethanamine is sourced from PubChem (CID 142835958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).