1-amino-3-ethoxy-N-(2-hydroxyethyl)-2,2-dimethyl-N-propylcyclobutane-1-carboxamide

C14H28N2O3 — CID 114828620

IUPAC1-amino-3-ethoxy-N-(2-hydroxyethyl)-2,2-dimethyl-N-propylcyclobutane-1-carboxamide
SMILESCCCN(CCO)C(=O)C1(N)CC(OCC)C1(C)C
InChIInChI=1S/C14H28N2O3/c1-5-7-16(8-9-17)12(18)14(15)10-11(19-6-2)13(14,3)4/h11,17H,5-10,15H2,1-4H3
InChIKeyIVUMWXJHJUXGAY-UHFFFAOYSA-N
MW272.39 g/mol
LogP0.75
Rot. Bonds7

About 1-amino-3-ethoxy-N-(2-hydroxyethyl)-2,2-dimethyl-N-propylcyclobutane-1-carboxamide

1-amino-3-ethoxy-N-(2-hydroxyethyl)-2,2-dimethyl-N-propylcyclobutane-1-carboxamide (PubChem CID 114828620) has the molecular formula C14H28N2O3 and a molecular weight of 272.39 g/mol. Its IUPAC name is 1-amino-3-ethoxy-N-(2-hydroxyethyl)-2,2-dimethyl-N-propylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-amino-3-ethoxy-N-(2-hydroxyethyl)-2,2-dimethyl-N-propylcyclobutane-1-carboxamide
PubChem CID114828620
Molecular FormulaC14H28N2O3
Molecular Weight272.39 g/mol
Exact Mass272.21
IUPAC Name1-amino-3-ethoxy-N-(2-hydroxyethyl)-2,2-dimethyl-N-propylcyclobutane-1-carboxamide
SMILESCCCN(CCO)C(=O)C1(N)CC(OCC)C1(C)C
InChIInChI=1S/C14H28N2O3/c1-5-7-16(8-9-17)12(18)14(15)10-11(19-6-2)13(14,3)4/h11,17H,5-10,15H2,1-4H3
InChIKeyIVUMWXJHJUXGAY-UHFFFAOYSA-N
XLogP0.75
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-3-ethoxy-2,2-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)cyclobutane-1-carboxamide
CID 114828630
1-amino-3-ethoxy-2,2-dimethyl-N-propyl-N-prop-2-ynylcyclobutane-1-carboxamide
CID 114829759
1-amino-3-ethoxy-N-ethyl-N,2,2-trimethylcyclobutane-1-carboxamide
CID 114828043
1-amino-N-cyclobutyl-3-ethoxy-N-(3-hydroxypropyl)-2,2-dimethylcyclobutane-1-carboxamide
CID 102861578
1-amino-3-ethoxy-N-methoxy-N,2,2-trimethylcyclobutane-1-carboxamide
CID 114828939
1-amino-3-ethoxy-2,2-dimethylcyclobutane-1-carboxamide
CID 114827911
trans-(1R,3R)-1-amino-3-ethoxy-2,2-dimethylcyclobutane-1-carboxylic acid
CID 97300458
1-amino-3-ethoxy-N,2,2-trimethyl-N-propan-2-ylcyclobutane-1-carboxamide;hydrochloride
CID 120607801
1-amino-3-ethoxy-N,2,2-trimethyl-N-[3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide
CID 105055949
1-amino-3-ethoxy-N-hydroxy-2,2-dimethylcyclobutane-1-carboxamide
CID 114829312
cis-methyl (1S,3R)-1-amino-3-ethoxy-2,2-dimethylcyclobutane-1-carboxylate;hydrochloride
CID 138991439
1-amino-3-ethoxy-N-(4-hydroxy-2,2-dimethylbutyl)-2,2-dimethylcyclobutane-1-carboxamide
CID 106147921

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-ethoxy-N-(2-hydroxyethyl)-2,2-dimethyl-N-propylcyclobutane-1-carboxamide?
The IUPAC name of 1-amino-3-ethoxy-N-(2-hydroxyethyl)-2,2-dimethyl-N-propylcyclobutane-1-carboxamide (CID 114828620) is 1-amino-3-ethoxy-N-(2-hydroxyethyl)-2,2-dimethyl-N-propylcyclobutane-1-carboxamide.
What is the SMILES notation for 1-amino-3-ethoxy-N-(2-hydroxyethyl)-2,2-dimethyl-N-propylcyclobutane-1-carboxamide?
The canonical SMILES for 1-amino-3-ethoxy-N-(2-hydroxyethyl)-2,2-dimethyl-N-propylcyclobutane-1-carboxamide is CCCN(CCO)C(=O)C1(N)CC(OCC)C1(C)C.
What is the InChIKey of 1-amino-3-ethoxy-N-(2-hydroxyethyl)-2,2-dimethyl-N-propylcyclobutane-1-carboxamide?
The InChIKey is IVUMWXJHJUXGAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O3/c1-5-7-16(8-9-17)12(18)14(15)10-11(19-6-2)13(14,3)4/h11,17H,5-10,15H2,1-4H3.
What are the key properties of 1-amino-3-ethoxy-N-(2-hydroxyethyl)-2,2-dimethyl-N-propylcyclobutane-1-carboxamide?
1-amino-3-ethoxy-N-(2-hydroxyethyl)-2,2-dimethyl-N-propylcyclobutane-1-carboxamide has a molecular weight of 272.39 g/mol, XLogP of 0.75, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-ethoxy-N-(2-hydroxyethyl)-2,2-dimethyl-N-propylcyclobutane-1-carboxamide is sourced from PubChem (CID 114828620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).