N,N,3,5,5-pentamethylhex-1-en-2-amine

C11H23N — CID 126581457

IUPACN,N,3,5,5-pentamethylhex-1-en-2-amine
SMILESC=C(C(C)CC(C)(C)C)N(C)C
InChIInChI=1S/C11H23N/c1-9(8-11(3,4)5)10(2)12(6)7/h9H,2,8H2,1,3-7H3
InChIKeyHTCOQNIQQFDZLS-UHFFFAOYSA-N
MW169.31 g/mol
LogP3.13
Rot. Bonds3

About N,N,3,5,5-pentamethylhex-1-en-2-amine

N,N,3,5,5-pentamethylhex-1-en-2-amine (PubChem CID 126581457) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N,N,3,5,5-pentamethylhex-1-en-2-amine.

Molecular Properties

Compound NameN,N,3,5,5-pentamethylhex-1-en-2-amine
PubChem CID126581457
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN,N,3,5,5-pentamethylhex-1-en-2-amine
SMILESC=C(C(C)CC(C)(C)C)N(C)C
InChIInChI=1S/C11H23N/c1-9(8-11(3,4)5)10(2)12(6)7/h9H,2,8H2,1,3-7H3
InChIKeyHTCOQNIQQFDZLS-UHFFFAOYSA-N
XLogP3.13
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N,3,5,5-pentamethylhex-1-en-2-amine?
The IUPAC name of N,N,3,5,5-pentamethylhex-1-en-2-amine (CID 126581457) is N,N,3,5,5-pentamethylhex-1-en-2-amine.
What is the SMILES notation for N,N,3,5,5-pentamethylhex-1-en-2-amine?
The canonical SMILES for N,N,3,5,5-pentamethylhex-1-en-2-amine is C=C(C(C)CC(C)(C)C)N(C)C.
What is the InChIKey of N,N,3,5,5-pentamethylhex-1-en-2-amine?
The InChIKey is HTCOQNIQQFDZLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-9(8-11(3,4)5)10(2)12(6)7/h9H,2,8H2,1,3-7H3.
What are the key properties of N,N,3,5,5-pentamethylhex-1-en-2-amine?
N,N,3,5,5-pentamethylhex-1-en-2-amine has a molecular weight of 169.31 g/mol, XLogP of 3.13, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3,5,5-pentamethylhex-1-en-2-amine is sourced from PubChem (CID 126581457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).