1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine

C11H24N2 — CID 170109208

IUPAC1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine
SMILESC=C(N(C)C(C)C)N(C)C(C)CC
InChIInChI=1S/C11H24N2/c1-8-10(4)13(7)11(5)12(6)9(2)3/h9-10H,5,8H2,1-4,6-7H3
InChIKeyQWRKUPCLJQBTTK-UHFFFAOYSA-N
MW184.33 g/mol
LogP2.53
Rot. Bonds5

About 1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine

1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine (PubChem CID 170109208) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine.

Molecular Properties

Compound Name1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine
PubChem CID170109208
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine
SMILESC=C(N(C)C(C)C)N(C)C(C)CC
InChIInChI=1S/C11H24N2/c1-8-10(4)13(7)11(5)12(6)9(2)3/h9-10H,5,8H2,1-4,6-7H3
InChIKeyQWRKUPCLJQBTTK-UHFFFAOYSA-N
XLogP2.53
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine?
The IUPAC name of 1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine (CID 170109208) is 1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine.
What is the SMILES notation for 1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine?
The canonical SMILES for 1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine is C=C(N(C)C(C)C)N(C)C(C)CC.
What is the InChIKey of 1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine?
The InChIKey is QWRKUPCLJQBTTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-8-10(4)13(7)11(5)12(6)9(2)3/h9-10H,5,8H2,1-4,6-7H3.
What are the key properties of 1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine?
1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine has a molecular weight of 184.33 g/mol, XLogP of 2.53, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N'-butan-2-yl-1-N,1-N'-dimethyl-1-N-propan-2-ylethene-1,1-diamine is sourced from PubChem (CID 170109208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).