1-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)cyclopropane-1-carboxamide

C12H22N2O2 — CID 103812051

IUPAC1-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)cyclopropane-1-carboxamide
SMILESCCOC1CC(NC(=O)C2(N)CC2)C1(C)C
InChIInChI=1S/C12H22N2O2/c1-4-16-9-7-8(11(9,2)3)14-10(15)12(13)5-6-12/h8-9H,4-7,13H2,1-3H3,(H,14,15)
InChIKeyVHPWHUIYVRLIOH-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.80
Rot. Bonds4

About 1-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)cyclopropane-1-carboxamide

1-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)cyclopropane-1-carboxamide (PubChem CID 103812051) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 1-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)cyclopropane-1-carboxamide
PubChem CID103812051
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name1-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)cyclopropane-1-carboxamide
SMILESCCOC1CC(NC(=O)C2(N)CC2)C1(C)C
InChIInChI=1S/C12H22N2O2/c1-4-16-9-7-8(11(9,2)3)14-10(15)12(13)5-6-12/h8-9H,4-7,13H2,1-3H3,(H,14,15)
InChIKeyVHPWHUIYVRLIOH-UHFFFAOYSA-N
XLogP0.80
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopropylmethyl)-2-[[2,2-dimethyl-3-[(2-methylpropan-2-yl)oxy]cyclobutyl]amino]acetamide
CID 126815236
2-[(3-methoxy-2,2-dimethylcyclobutyl)amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 103742132
2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 103921107
2-amino-3,3,3-trifluoro-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-methylpropanamide
CID 105840624
2-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)-3,3,3-trifluoro-2-methylpropanamide
CID 105840898
(2R)-2-amino-N-(3-hydroxy-2,2,4,4-tetramethylcyclobutyl)pentanamide
CID 14723635
(2S)-2-amino-N-[3-(cyclopropylmethoxy)propyl]-4-methylpentanamide
CID 61155391
2-methyl-N-(2,2,4,4-tetramethyl-3-propan-2-yloxycyclobutyl)propanamide
CID 166011519
4,4-dimethyl-N-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]pentanamide
CID 172516048
2-amino-N-[3-(cyclopropylmethoxy)propyl]-4-methylpentanamide
CID 43515325
5-Cyclobutyloxy-2-(cyclopropylamino)-2-methylpentanamide
CID 55041217
2-amino-N-[3-(cyclopropylmethoxy)propyl]-2-methylpentanamide
CID 60847343

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)cyclopropane-1-carboxamide (CID 103812051) is 1-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)cyclopropane-1-carboxamide is CCOC1CC(NC(=O)C2(N)CC2)C1(C)C.
What is the InChIKey of 1-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)cyclopropane-1-carboxamide?
The InChIKey is VHPWHUIYVRLIOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-4-16-9-7-8(11(9,2)3)14-10(15)12(13)5-6-12/h8-9H,4-7,13H2,1-3H3,(H,14,15).
What are the key properties of 1-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)cyclopropane-1-carboxamide?
1-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)cyclopropane-1-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(3-ethoxy-2,2-dimethylcyclobutyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 103812051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).