1-[1-(3-methoxypropyl)cyclopropyl]ethanamine

C9H19NO — CID 106797370

IUPAC1-[1-(3-methoxypropyl)cyclopropyl]ethanamine
SMILESCOCCCC1(C(C)N)CC1
InChIInChI=1S/C9H19NO/c1-8(10)9(5-6-9)4-3-7-11-2/h8H,3-7,10H2,1-2H3
InChIKeyGBFMPYNPYQWTOF-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.54
Rot. Bonds5

About 1-[1-(3-methoxypropyl)cyclopropyl]ethanamine

1-[1-(3-methoxypropyl)cyclopropyl]ethanamine (PubChem CID 106797370) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 1-[1-(3-methoxypropyl)cyclopropyl]ethanamine.

Molecular Properties

Compound Name1-[1-(3-methoxypropyl)cyclopropyl]ethanamine
PubChem CID106797370
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name1-[1-(3-methoxypropyl)cyclopropyl]ethanamine
SMILESCOCCCC1(C(C)N)CC1
InChIInChI=1S/C9H19NO/c1-8(10)9(5-6-9)4-3-7-11-2/h8H,3-7,10H2,1-2H3
InChIKeyGBFMPYNPYQWTOF-UHFFFAOYSA-N
XLogP1.54
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(1-bromoethyl)-1-[3-(2-methoxyethoxy)propyl]cyclopropane
CID 106798673
1-[1-(2-methylsulfanylethyl)cyclopropyl]ethanamine
CID 106797380
(1S)-1-[(1R,2R)-2-amino-2-(3-methoxypropyl)cyclohexyl]ethanol
CID 11550281
N-[1-[1-[3-(2-methoxyethoxy)propyl]cyclopropyl]ethyl]propan-1-amine
CID 106797997
N-[[1-(3-methoxypropyl)cyclopropyl]methyl]propan-2-amine
CID 66024015
(2S)-5-methoxypentan-2-amine
CID 93315322
1-(chloromethyl)-1-(4-methoxybutan-2-yl)cyclopentane
CID 116500273
2-(3-methoxypropyl)-2-propan-2-ylpiperidine
CID 117271103
2-[1-(1-aminoethyl)cyclohexyl]ethanol
CID 66091695
[1-(4-methoxybutyl)cyclopropyl]methanamine
CID 104649416
1-(3-methoxypropyl)-3-propan-2-ylcyclobutan-1-ol
CID 103564186
8-methoxy-4-methyloctan-3-amine
CID 104648383

Frequently Asked Questions

What is the IUPAC name of 1-[1-(3-methoxypropyl)cyclopropyl]ethanamine?
The IUPAC name of 1-[1-(3-methoxypropyl)cyclopropyl]ethanamine (CID 106797370) is 1-[1-(3-methoxypropyl)cyclopropyl]ethanamine.
What is the SMILES notation for 1-[1-(3-methoxypropyl)cyclopropyl]ethanamine?
The canonical SMILES for 1-[1-(3-methoxypropyl)cyclopropyl]ethanamine is COCCCC1(C(C)N)CC1.
What is the InChIKey of 1-[1-(3-methoxypropyl)cyclopropyl]ethanamine?
The InChIKey is GBFMPYNPYQWTOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-8(10)9(5-6-9)4-3-7-11-2/h8H,3-7,10H2,1-2H3.
What are the key properties of 1-[1-(3-methoxypropyl)cyclopropyl]ethanamine?
1-[1-(3-methoxypropyl)cyclopropyl]ethanamine has a molecular weight of 157.26 g/mol, XLogP of 1.54, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(3-methoxypropyl)cyclopropyl]ethanamine is sourced from PubChem (CID 106797370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).