N-(3-aminopropyl)-2-(3-ethoxycyclobutyl)-N-phenylacetamide

C17H26N2O2 — CID 103161343

IUPACN-(3-aminopropyl)-2-(3-ethoxycyclobutyl)-N-phenylacetamide
SMILESCCOC1CC(CC(=O)N(CCCN)c2ccccc2)C1
InChIInChI=1S/C17H26N2O2/c1-2-21-16-11-14(12-16)13-17(20)19(10-6-9-18)15-7-4-3-5-8-15/h3-5,7-8,14,16H,2,6,9-13,18H2,1H3
InChIKeyPGGIRCJXYOKDDX-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.57
Rot. Bonds8

About N-(3-aminopropyl)-2-(3-ethoxycyclobutyl)-N-phenylacetamide

N-(3-aminopropyl)-2-(3-ethoxycyclobutyl)-N-phenylacetamide (PubChem CID 103161343) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(3-aminopropyl)-2-(3-ethoxycyclobutyl)-N-phenylacetamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-2-(3-ethoxycyclobutyl)-N-phenylacetamide
PubChem CID103161343
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-(3-aminopropyl)-2-(3-ethoxycyclobutyl)-N-phenylacetamide
SMILESCCOC1CC(CC(=O)N(CCCN)c2ccccc2)C1
InChIInChI=1S/C17H26N2O2/c1-2-21-16-11-14(12-16)13-17(20)19(10-6-9-18)15-7-4-3-5-8-15/h3-5,7-8,14,16H,2,6,9-13,18H2,1H3
InChIKeyPGGIRCJXYOKDDX-UHFFFAOYSA-N
XLogP2.57
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(N-[2-(3-ethoxycyclobutyl)acetyl]anilino)acetic acid
CID 103161788
N-(4-aminophenyl)-2-(3-ethoxycyclobutyl)-N-propylacetamide
CID 103161636
N-(3-aminopropyl)-2-phenoxy-N-phenylacetamide
CID 28766720
2-[3-aminopropyl(methyl)amino]-N-ethyl-N-phenylacetamide
CID 81494005
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-ethyl-N-phenylacetamide
CID 79607499
N-(3-aminopropyl)-N-phenyl-2-(2,2,2-trifluoroethoxy)acetamide
CID 103205322
4-[N-(3-aminopropanoyl)anilino]butanoic acid
CID 61161462
1-(3-aminopropyl)-3-butyl-1-phenylurea
CID 43135983
N-(3-aminopropyl)-2-methylsulfonyl-N-phenylpropanamide
CID 104517075
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-phenyl-N-(2-phenylethyl)acetamide
CID 119753320
4-amino-N-ethyl-N-phenylbutanamide;hydrochloride
CID 119261842
1-(2-chlorophenyl)-2-(3-ethoxycyclobutyl)ethanone
CID 103167728

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-2-(3-ethoxycyclobutyl)-N-phenylacetamide?
The IUPAC name of N-(3-aminopropyl)-2-(3-ethoxycyclobutyl)-N-phenylacetamide (CID 103161343) is N-(3-aminopropyl)-2-(3-ethoxycyclobutyl)-N-phenylacetamide.
What is the SMILES notation for N-(3-aminopropyl)-2-(3-ethoxycyclobutyl)-N-phenylacetamide?
The canonical SMILES for N-(3-aminopropyl)-2-(3-ethoxycyclobutyl)-N-phenylacetamide is CCOC1CC(CC(=O)N(CCCN)c2ccccc2)C1.
What is the InChIKey of N-(3-aminopropyl)-2-(3-ethoxycyclobutyl)-N-phenylacetamide?
The InChIKey is PGGIRCJXYOKDDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-2-21-16-11-14(12-16)13-17(20)19(10-6-9-18)15-7-4-3-5-8-15/h3-5,7-8,14,16H,2,6,9-13,18H2,1H3.
What are the key properties of N-(3-aminopropyl)-2-(3-ethoxycyclobutyl)-N-phenylacetamide?
N-(3-aminopropyl)-2-(3-ethoxycyclobutyl)-N-phenylacetamide has a molecular weight of 290.41 g/mol, XLogP of 2.57, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-2-(3-ethoxycyclobutyl)-N-phenylacetamide is sourced from PubChem (CID 103161343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).