3-ethyl-N-propan-2-ylpent-1-en-2-amine

C10H21N — CID 131998081

IUPAC3-ethyl-N-propan-2-ylpent-1-en-2-amine
SMILESC=C(NC(C)C)C(CC)CC
InChIInChI=1S/C10H21N/c1-6-10(7-2)9(5)11-8(3)4/h8,10-11H,5-7H2,1-4H3
InChIKeyLIDACEOJKUXDPG-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.93
Rot. Bonds5

About 3-ethyl-N-propan-2-ylpent-1-en-2-amine

3-ethyl-N-propan-2-ylpent-1-en-2-amine (PubChem CID 131998081) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is 3-ethyl-N-propan-2-ylpent-1-en-2-amine.

Molecular Properties

Compound Name3-ethyl-N-propan-2-ylpent-1-en-2-amine
PubChem CID131998081
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name3-ethyl-N-propan-2-ylpent-1-en-2-amine
SMILESC=C(NC(C)C)C(CC)CC
InChIInChI=1S/C10H21N/c1-6-10(7-2)9(5)11-8(3)4/h8,10-11H,5-7H2,1-4H3
InChIKeyLIDACEOJKUXDPG-UHFFFAOYSA-N
XLogP2.93
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-propan-2-ylpent-1-en-2-amine?
The IUPAC name of 3-ethyl-N-propan-2-ylpent-1-en-2-amine (CID 131998081) is 3-ethyl-N-propan-2-ylpent-1-en-2-amine.
What is the SMILES notation for 3-ethyl-N-propan-2-ylpent-1-en-2-amine?
The canonical SMILES for 3-ethyl-N-propan-2-ylpent-1-en-2-amine is C=C(NC(C)C)C(CC)CC.
What is the InChIKey of 3-ethyl-N-propan-2-ylpent-1-en-2-amine?
The InChIKey is LIDACEOJKUXDPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-6-10(7-2)9(5)11-8(3)4/h8,10-11H,5-7H2,1-4H3.
What are the key properties of 3-ethyl-N-propan-2-ylpent-1-en-2-amine?
3-ethyl-N-propan-2-ylpent-1-en-2-amine has a molecular weight of 155.28 g/mol, XLogP of 2.93, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-propan-2-ylpent-1-en-2-amine is sourced from PubChem (CID 131998081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).