2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide

C14H28N2O2 — CID 112554585

IUPAC2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide
SMILESCCOC1CC(NC(CC(C)C)C(=O)N(C)C)C1
InChIInChI=1S/C14H28N2O2/c1-6-18-12-8-11(9-12)15-13(7-10(2)3)14(17)16(4)5/h10-13,15H,6-9H2,1-5H3
InChIKeyLDBYZDGXISNKAY-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.65
Rot. Bonds7

About 2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide

2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide (PubChem CID 112554585) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide.

Molecular Properties

Compound Name2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide
PubChem CID112554585
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide
SMILESCCOC1CC(NC(CC(C)C)C(=O)N(C)C)C1
InChIInChI=1S/C14H28N2O2/c1-6-18-12-8-11(9-12)15-13(7-10(2)3)14(17)16(4)5/h10-13,15H,6-9H2,1-5H3
InChIKeyLDBYZDGXISNKAY-UHFFFAOYSA-N
XLogP1.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-4-methyl-1-(4-propoxyazepan-1-yl)pentan-1-one
CID 119042678
2-Amino-4-methylpentanoic acid (3-ethoxypropyl)amide
CID 22170008
2-amino-N-(3-ethoxypropyl)-4-methylpentanamide;hydrochloride
CID 22170018
3-Methoxypropyl L-Leucinamide
CID 22690994
(2S)-2-amino-N-(3-ethoxypropyl)-4-methylpentanamide
CID 23568570
L-leucine-3-ethoxypropylamide hydrochloride
CID 23568571
(2S)-2-amino-N-[3-(cyclopropylmethoxy)propyl]-4-methylpentanamide
CID 61155391
(2S)-2-amino-4-methyl-N-(3-propan-2-yloxypropyl)pentanamide
CID 61275418
(2S)-2-(3-ethoxypropylamino)-4-methylpentanamide
CID 87873810
(2S)-2-amino-4-methyl-1-(4-propan-2-yloxypiperidin-1-yl)pentan-1-one
CID 118427461
2-(diethylamino)-N-[3-[1-[2,4-dimethyl-5-(methylamino)pentyl]piperidin-4-yl]oxycyclobutyl]acetamide
CID 139356811
(2S)-2-amino-N-(3-methoxypropyl)-4-methylpentanamide;ethane
CID 142924272

Frequently Asked Questions

What is the IUPAC name of 2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide?
The IUPAC name of 2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide (CID 112554585) is 2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide.
What is the SMILES notation for 2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide?
The canonical SMILES for 2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide is CCOC1CC(NC(CC(C)C)C(=O)N(C)C)C1.
What is the InChIKey of 2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide?
The InChIKey is LDBYZDGXISNKAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-6-18-12-8-11(9-12)15-13(7-10(2)3)14(17)16(4)5/h10-13,15H,6-9H2,1-5H3.
What are the key properties of 2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide?
2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide has a molecular weight of 256.39 g/mol, XLogP of 1.65, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-ethoxycyclobutyl)amino]-N,N,4-trimethylpentanamide is sourced from PubChem (CID 112554585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).