3-N,3-N,4,4-tetramethyl-2-N-propan-2-ylpent-1-ene-2,3-diamine

C12H26N2 — CID 137413172

IUPAC3-N,3-N,4,4-tetramethyl-2-N-propan-2-ylpent-1-ene-2,3-diamine
SMILESC=C(NC(C)C)C(N(C)C)C(C)(C)C
InChIInChI=1S/C12H26N2/c1-9(2)13-10(3)11(14(7)8)12(4,5)6/h9,11,13H,3H2,1-2,4-8H3
InChIKeyFFNDNUQWCVUUJL-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.47
Rot. Bonds4

About 3-N,3-N,4,4-tetramethyl-2-N-propan-2-ylpent-1-ene-2,3-diamine

3-N,3-N,4,4-tetramethyl-2-N-propan-2-ylpent-1-ene-2,3-diamine (PubChem CID 137413172) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is 3-N,3-N,4,4-tetramethyl-2-N-propan-2-ylpent-1-ene-2,3-diamine.

Molecular Properties

Compound Name3-N,3-N,4,4-tetramethyl-2-N-propan-2-ylpent-1-ene-2,3-diamine
PubChem CID137413172
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC Name3-N,3-N,4,4-tetramethyl-2-N-propan-2-ylpent-1-ene-2,3-diamine
SMILESC=C(NC(C)C)C(N(C)C)C(C)(C)C
InChIInChI=1S/C12H26N2/c1-9(2)13-10(3)11(14(7)8)12(4,5)6/h9,11,13H,3H2,1-2,4-8H3
InChIKeyFFNDNUQWCVUUJL-UHFFFAOYSA-N
XLogP2.47
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-N,3-N,4,4-tetramethyl-2-N-propan-2-ylpent-1-ene-2,3-diamine?
The IUPAC name of 3-N,3-N,4,4-tetramethyl-2-N-propan-2-ylpent-1-ene-2,3-diamine (CID 137413172) is 3-N,3-N,4,4-tetramethyl-2-N-propan-2-ylpent-1-ene-2,3-diamine.
What is the SMILES notation for 3-N,3-N,4,4-tetramethyl-2-N-propan-2-ylpent-1-ene-2,3-diamine?
The canonical SMILES for 3-N,3-N,4,4-tetramethyl-2-N-propan-2-ylpent-1-ene-2,3-diamine is C=C(NC(C)C)C(N(C)C)C(C)(C)C.
What is the InChIKey of 3-N,3-N,4,4-tetramethyl-2-N-propan-2-ylpent-1-ene-2,3-diamine?
The InChIKey is FFNDNUQWCVUUJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-9(2)13-10(3)11(14(7)8)12(4,5)6/h9,11,13H,3H2,1-2,4-8H3.
What are the key properties of 3-N,3-N,4,4-tetramethyl-2-N-propan-2-ylpent-1-ene-2,3-diamine?
3-N,3-N,4,4-tetramethyl-2-N-propan-2-ylpent-1-ene-2,3-diamine has a molecular weight of 198.35 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N,4,4-tetramethyl-2-N-propan-2-ylpent-1-ene-2,3-diamine is sourced from PubChem (CID 137413172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).