N,3,4-trimethyl-3-propan-2-ylpent-1-en-2-amine

C11H23N — CID 89279254

IUPACN,3,4-trimethyl-3-propan-2-ylpent-1-en-2-amine
SMILESC=C(NC)C(C)(C(C)C)C(C)C
InChIInChI=1S/C11H23N/c1-8(2)11(6,9(3)4)10(5)12-7/h8-9,12H,5H2,1-4,6-7H3
InChIKeyBISAISFCFOYEED-UHFFFAOYSA-N
MW169.31 g/mol
LogP3.04
Rot. Bonds4

About N,3,4-trimethyl-3-propan-2-ylpent-1-en-2-amine

N,3,4-trimethyl-3-propan-2-ylpent-1-en-2-amine (PubChem CID 89279254) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N,3,4-trimethyl-3-propan-2-ylpent-1-en-2-amine.

Molecular Properties

Compound NameN,3,4-trimethyl-3-propan-2-ylpent-1-en-2-amine
PubChem CID89279254
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN,3,4-trimethyl-3-propan-2-ylpent-1-en-2-amine
SMILESC=C(NC)C(C)(C(C)C)C(C)C
InChIInChI=1S/C11H23N/c1-8(2)11(6,9(3)4)10(5)12-7/h8-9,12H,5H2,1-4,6-7H3
InChIKeyBISAISFCFOYEED-UHFFFAOYSA-N
XLogP3.04
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,3,4-trimethyl-3-propan-2-ylpent-1-en-2-amine?
The IUPAC name of N,3,4-trimethyl-3-propan-2-ylpent-1-en-2-amine (CID 89279254) is N,3,4-trimethyl-3-propan-2-ylpent-1-en-2-amine.
What is the SMILES notation for N,3,4-trimethyl-3-propan-2-ylpent-1-en-2-amine?
The canonical SMILES for N,3,4-trimethyl-3-propan-2-ylpent-1-en-2-amine is C=C(NC)C(C)(C(C)C)C(C)C.
What is the InChIKey of N,3,4-trimethyl-3-propan-2-ylpent-1-en-2-amine?
The InChIKey is BISAISFCFOYEED-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-8(2)11(6,9(3)4)10(5)12-7/h8-9,12H,5H2,1-4,6-7H3.
What are the key properties of N,3,4-trimethyl-3-propan-2-ylpent-1-en-2-amine?
N,3,4-trimethyl-3-propan-2-ylpent-1-en-2-amine has a molecular weight of 169.31 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,3,4-trimethyl-3-propan-2-ylpent-1-en-2-amine is sourced from PubChem (CID 89279254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).