N-[2-[cyclopropyl(2-methylbutanoyl)amino]ethyl]-2-methylbutanamide

C15H28N2O2 — CID 71934538

IUPACN-[2-[cyclopropyl(2-methylbutanoyl)amino]ethyl]-2-methylbutanamide
SMILESCCC(C)C(=O)NCCN(C(=O)C(C)CC)C1CC1
InChIInChI=1S/C15H28N2O2/c1-5-11(3)14(18)16-9-10-17(13-7-8-13)15(19)12(4)6-2/h11-13H,5-10H2,1-4H3,(H,16,18)
InChIKeyKOHMKAYNVBOADF-UHFFFAOYSA-N
MW268.40 g/mol
LogP2.19
Rot. Bonds8

About N-[2-[cyclopropyl(2-methylbutanoyl)amino]ethyl]-2-methylbutanamide

N-[2-[cyclopropyl(2-methylbutanoyl)amino]ethyl]-2-methylbutanamide (PubChem CID 71934538) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[2-[cyclopropyl(2-methylbutanoyl)amino]ethyl]-2-methylbutanamide.

Molecular Properties

Compound NameN-[2-[cyclopropyl(2-methylbutanoyl)amino]ethyl]-2-methylbutanamide
PubChem CID71934538
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-[2-[cyclopropyl(2-methylbutanoyl)amino]ethyl]-2-methylbutanamide
SMILESCCC(C)C(=O)NCCN(C(=O)C(C)CC)C1CC1
InChIInChI=1S/C15H28N2O2/c1-5-11(3)14(18)16-9-10-17(13-7-8-13)15(19)12(4)6-2/h11-13H,5-10H2,1-4H3,(H,16,18)
InChIKeyKOHMKAYNVBOADF-UHFFFAOYSA-N
XLogP2.19
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-aminopropyl)-N-cyclopropyl-2-methylbutanamide
CID 43136751
N-(3-aminopropyl)-N-cyclohexyl-2-methylbutanamide
CID 43136859
N-[2-[ethyl(methyl)amino]ethyl]-2-methylbutanamide
CID 20730110
N-[2-[acetyl(cyclopentyl)amino]ethyl]-2-methylpropanamide
CID 113052772
(2S,3S)-2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-3-methylpentanamide
CID 62975934
3-methoxy-2-methyl-N-piperidin-4-yl-N-propylpropanamide
CID 119824204
(2S)-2-amino-N-[2-[cyclopropyl(ethyl)amino]ethyl]propanamide
CID 103814330
N-(2-cyanoethyl)-N-cyclopropyl-3-(ethylamino)-2-methylpropanamide
CID 62854021
N-(3-ethoxypropyl)-2-methylbutanamide
CID 88934597
N-cyclopentyl-N-[2-(4-fluorophenyl)ethyl]-2-methylbutanamide
CID 78853629
6-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-methylheptanamide
CID 65291228
N-[2-(4-aminocyclohexyl)oxyethyl]-2-methylbutanamide
CID 63869286

Frequently Asked Questions

What is the IUPAC name of N-[2-[cyclopropyl(2-methylbutanoyl)amino]ethyl]-2-methylbutanamide?
The IUPAC name of N-[2-[cyclopropyl(2-methylbutanoyl)amino]ethyl]-2-methylbutanamide (CID 71934538) is N-[2-[cyclopropyl(2-methylbutanoyl)amino]ethyl]-2-methylbutanamide.
What is the SMILES notation for N-[2-[cyclopropyl(2-methylbutanoyl)amino]ethyl]-2-methylbutanamide?
The canonical SMILES for N-[2-[cyclopropyl(2-methylbutanoyl)amino]ethyl]-2-methylbutanamide is CCC(C)C(=O)NCCN(C(=O)C(C)CC)C1CC1.
What is the InChIKey of N-[2-[cyclopropyl(2-methylbutanoyl)amino]ethyl]-2-methylbutanamide?
The InChIKey is KOHMKAYNVBOADF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-5-11(3)14(18)16-9-10-17(13-7-8-13)15(19)12(4)6-2/h11-13H,5-10H2,1-4H3,(H,16,18).
What are the key properties of N-[2-[cyclopropyl(2-methylbutanoyl)amino]ethyl]-2-methylbutanamide?
N-[2-[cyclopropyl(2-methylbutanoyl)amino]ethyl]-2-methylbutanamide has a molecular weight of 268.40 g/mol, XLogP of 2.19, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[cyclopropyl(2-methylbutanoyl)amino]ethyl]-2-methylbutanamide is sourced from PubChem (CID 71934538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).