1-(3-ethoxycyclobutyl)propan-2-amine

C9H19NO — CID 103168219

IUPAC1-(3-ethoxycyclobutyl)propan-2-amine
SMILESCCOC1CC(CC(C)N)C1
InChIInChI=1S/C9H19NO/c1-3-11-9-5-8(6-9)4-7(2)10/h7-9H,3-6,10H2,1-2H3
InChIKeyHNXMPKRUYIGDOU-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.54
Rot. Bonds4

About 1-(3-ethoxycyclobutyl)propan-2-amine

1-(3-ethoxycyclobutyl)propan-2-amine (PubChem CID 103168219) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 1-(3-ethoxycyclobutyl)propan-2-amine.

Molecular Properties

Compound Name1-(3-ethoxycyclobutyl)propan-2-amine
PubChem CID103168219
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name1-(3-ethoxycyclobutyl)propan-2-amine
SMILESCCOC1CC(CC(C)N)C1
InChIInChI=1S/C9H19NO/c1-3-11-9-5-8(6-9)4-7(2)10/h7-9H,3-6,10H2,1-2H3
InChIKeyHNXMPKRUYIGDOU-UHFFFAOYSA-N
XLogP1.54
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(Oxan-4-yl)propan-2-amine
CID 21054632
3-Ethoxy-2,2-diethylcyclobutan-1-amine
CID 64568592
2,2-Diethyl-3-methoxy-4-methylcyclobutan-1-amine
CID 71757966
2-(3-Ethoxycyclobutyl)ethan-1-amine
CID 75525843
2-[3-(Tert-butoxy)cyclobutyl]ethan-1-amine
CID 86775227
7-Methyl-6-oxaspiro[3.4]octan-2-amine
CID 132327971
6-Methoxyspiro[3.3]heptan-2-amine hydrochloride
CID 137935255
1-(4-Ethoxycyclohexyl)ethan-1-amine hydrochloride
CID 154842558
1-Pentanamine, 3-[(2-ethylhexyl)oxy]-
CID 19432124
6-Methoxyspiro[3.3]heptan-2-amine
CID 137935256
1-(3-Ethoxycyclobutyl)-5,5,5-trifluoropentan-2-amine
CID 103168855
1-(3-Ethoxycyclobutyl)-6,6,6-trifluorohexan-2-amine
CID 103169305

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxycyclobutyl)propan-2-amine?
The IUPAC name of 1-(3-ethoxycyclobutyl)propan-2-amine (CID 103168219) is 1-(3-ethoxycyclobutyl)propan-2-amine.
What is the SMILES notation for 1-(3-ethoxycyclobutyl)propan-2-amine?
The canonical SMILES for 1-(3-ethoxycyclobutyl)propan-2-amine is CCOC1CC(CC(C)N)C1.
What is the InChIKey of 1-(3-ethoxycyclobutyl)propan-2-amine?
The InChIKey is HNXMPKRUYIGDOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-3-11-9-5-8(6-9)4-7(2)10/h7-9H,3-6,10H2,1-2H3.
What are the key properties of 1-(3-ethoxycyclobutyl)propan-2-amine?
1-(3-ethoxycyclobutyl)propan-2-amine has a molecular weight of 157.26 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxycyclobutyl)propan-2-amine is sourced from PubChem (CID 103168219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).