4-methyl-N-prop-1-en-2-ylpentan-2-amine

C9H19N — CID 89013130

IUPAC4-methyl-N-prop-1-en-2-ylpentan-2-amine
SMILESC=C(C)NC(C)CC(C)C
InChIInChI=1S/C9H19N/c1-7(2)6-9(5)10-8(3)4/h7,9-10H,3,6H2,1-2,4-5H3
InChIKeyRTEFQXAEVVBSQL-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.54
Rot. Bonds4

About 4-methyl-N-prop-1-en-2-ylpentan-2-amine

4-methyl-N-prop-1-en-2-ylpentan-2-amine (PubChem CID 89013130) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is 4-methyl-N-prop-1-en-2-ylpentan-2-amine.

Molecular Properties

Compound Name4-methyl-N-prop-1-en-2-ylpentan-2-amine
PubChem CID89013130
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name4-methyl-N-prop-1-en-2-ylpentan-2-amine
SMILESC=C(C)NC(C)CC(C)C
InChIInChI=1S/C9H19N/c1-7(2)6-9(5)10-8(3)4/h7,9-10H,3,6H2,1-2,4-5H3
InChIKeyRTEFQXAEVVBSQL-UHFFFAOYSA-N
XLogP2.54
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-prop-1-en-2-ylpentan-2-amine?
The IUPAC name of 4-methyl-N-prop-1-en-2-ylpentan-2-amine (CID 89013130) is 4-methyl-N-prop-1-en-2-ylpentan-2-amine.
What is the SMILES notation for 4-methyl-N-prop-1-en-2-ylpentan-2-amine?
The canonical SMILES for 4-methyl-N-prop-1-en-2-ylpentan-2-amine is C=C(C)NC(C)CC(C)C.
What is the InChIKey of 4-methyl-N-prop-1-en-2-ylpentan-2-amine?
The InChIKey is RTEFQXAEVVBSQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-7(2)6-9(5)10-8(3)4/h7,9-10H,3,6H2,1-2,4-5H3.
What are the key properties of 4-methyl-N-prop-1-en-2-ylpentan-2-amine?
4-methyl-N-prop-1-en-2-ylpentan-2-amine has a molecular weight of 141.26 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-prop-1-en-2-ylpentan-2-amine is sourced from PubChem (CID 89013130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).