N-ethyl-N-propan-2-ylbutan-2-amine

C9H21N — CID 20659804

IUPACN-ethyl-N-propan-2-ylbutan-2-amine
SMILESCCC(C)N(CC)C(C)C
InChIInChI=1S/C9H21N/c1-6-9(5)10(7-2)8(3)4/h8-9H,6-7H2,1-5H3
InChIKeyWHNWJSAZQDNLFP-UHFFFAOYSA-N
MW143.27 g/mol
LogP2.52
Rot. Bonds4

About N-ethyl-N-propan-2-ylbutan-2-amine

N-ethyl-N-propan-2-ylbutan-2-amine (PubChem CID 20659804) has the molecular formula C9H21N and a molecular weight of 143.27 g/mol. Its IUPAC name is N-ethyl-N-propan-2-ylbutan-2-amine.

Molecular Properties

Compound NameN-ethyl-N-propan-2-ylbutan-2-amine
PubChem CID20659804
Molecular FormulaC9H21N
Molecular Weight143.27 g/mol
Exact Mass143.17
IUPAC NameN-ethyl-N-propan-2-ylbutan-2-amine
SMILESCCC(C)N(CC)C(C)C
InChIInChI=1S/C9H21N/c1-6-9(5)10(7-2)8(3)4/h8-9H,6-7H2,1-5H3
InChIKeyWHNWJSAZQDNLFP-UHFFFAOYSA-N
XLogP2.52
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.27
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-propan-2-ylbutan-2-amine?
The IUPAC name of N-ethyl-N-propan-2-ylbutan-2-amine (CID 20659804) is N-ethyl-N-propan-2-ylbutan-2-amine.
What is the SMILES notation for N-ethyl-N-propan-2-ylbutan-2-amine?
The canonical SMILES for N-ethyl-N-propan-2-ylbutan-2-amine is CCC(C)N(CC)C(C)C.
What is the InChIKey of N-ethyl-N-propan-2-ylbutan-2-amine?
The InChIKey is WHNWJSAZQDNLFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N/c1-6-9(5)10(7-2)8(3)4/h8-9H,6-7H2,1-5H3.
What are the key properties of N-ethyl-N-propan-2-ylbutan-2-amine?
N-ethyl-N-propan-2-ylbutan-2-amine has a molecular weight of 143.27 g/mol, XLogP of 2.52, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-propan-2-ylbutan-2-amine is sourced from PubChem (CID 20659804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).