N-butan-2-yl-2-methyl-N-propylpropanamide

C11H23NO — CID 153425252

IUPACN-butan-2-yl-2-methyl-N-propylpropanamide
SMILESCCCN(C(=O)C(C)C)C(C)CC
InChIInChI=1S/C11H23NO/c1-6-8-12(10(5)7-2)11(13)9(3)4/h9-10H,6-8H2,1-5H3
InChIKeyUUYBDNXRVYRJIR-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.68
Rot. Bonds5

About N-butan-2-yl-2-methyl-N-propylpropanamide

N-butan-2-yl-2-methyl-N-propylpropanamide (PubChem CID 153425252) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is N-butan-2-yl-2-methyl-N-propylpropanamide.

Molecular Properties

Compound NameN-butan-2-yl-2-methyl-N-propylpropanamide
PubChem CID153425252
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC NameN-butan-2-yl-2-methyl-N-propylpropanamide
SMILESCCCN(C(=O)C(C)C)C(C)CC
InChIInChI=1S/C11H23NO/c1-6-8-12(10(5)7-2)11(13)9(3)4/h9-10H,6-8H2,1-5H3
InChIKeyUUYBDNXRVYRJIR-UHFFFAOYSA-N
XLogP2.68
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-methyl-N-propylpropanamide?
The IUPAC name of N-butan-2-yl-2-methyl-N-propylpropanamide (CID 153425252) is N-butan-2-yl-2-methyl-N-propylpropanamide.
What is the SMILES notation for N-butan-2-yl-2-methyl-N-propylpropanamide?
The canonical SMILES for N-butan-2-yl-2-methyl-N-propylpropanamide is CCCN(C(=O)C(C)C)C(C)CC.
What is the InChIKey of N-butan-2-yl-2-methyl-N-propylpropanamide?
The InChIKey is UUYBDNXRVYRJIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-6-8-12(10(5)7-2)11(13)9(3)4/h9-10H,6-8H2,1-5H3.
What are the key properties of N-butan-2-yl-2-methyl-N-propylpropanamide?
N-butan-2-yl-2-methyl-N-propylpropanamide has a molecular weight of 185.31 g/mol, XLogP of 2.68, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-methyl-N-propylpropanamide is sourced from PubChem (CID 153425252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).