3-(2-cyclopropylethoxy)-2-methylpropan-1-amine

C9H19NO — CID 106203362

IUPAC3-(2-cyclopropylethoxy)-2-methylpropan-1-amine
SMILESCC(CN)COCCC1CC1
InChIInChI=1S/C9H19NO/c1-8(6-10)7-11-5-4-9-2-3-9/h8-9H,2-7,10H2,1H3
InChIKeyXYCLQYNIIZJNOQ-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.40
Rot. Bonds6

About 3-(2-cyclopropylethoxy)-2-methylpropan-1-amine

3-(2-cyclopropylethoxy)-2-methylpropan-1-amine (PubChem CID 106203362) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 3-(2-cyclopropylethoxy)-2-methylpropan-1-amine.

Molecular Properties

Compound Name3-(2-cyclopropylethoxy)-2-methylpropan-1-amine
PubChem CID106203362
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name3-(2-cyclopropylethoxy)-2-methylpropan-1-amine
SMILESCC(CN)COCCC1CC1
InChIInChI=1S/C9H19NO/c1-8(6-10)7-11-5-4-9-2-3-9/h8-9H,2-7,10H2,1H3
InChIKeyXYCLQYNIIZJNOQ-UHFFFAOYSA-N
XLogP1.40
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.40
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-(2-cyclopropylethoxy)propan-2-amine
CID 106200486
(2S)-1-(2-cyclopropylethoxy)propan-2-ol
CID 106203926
3-(2-cyclopropylethoxy)-2-ethoxypropan-1-amine
CID 106200247
2-(2-cyclopropylethoxy)-3-methylbutan-1-amine
CID 106205725
6-[(2S)-2-methylbutoxy]hexylcyclopropane
CID 167130776
(2S)-1-(2-cyclobutylethoxy)propan-2-ol
CID 106204019
2-cyclopropylethyl 2-(aminomethyl)-4-methylpentanoate
CID 106202639
2-(2-cyclopropylethoxy)propanethioamide
CID 106201781
2-methyl-3-pent-4-enoxypropan-1-amine
CID 103074871
(Z)-3-[[4-(2-cyclopropylethoxy)-3-methylbutyl]amino]prop-2-enal
CID 170094608
3-ethoxy-2-methylpropan-1-amine
CID 43175050
ethyl 2-amino-3-(2-cyclopropylethoxy)propanoate
CID 106204429

Frequently Asked Questions

What is the IUPAC name of 3-(2-cyclopropylethoxy)-2-methylpropan-1-amine?
The IUPAC name of 3-(2-cyclopropylethoxy)-2-methylpropan-1-amine (CID 106203362) is 3-(2-cyclopropylethoxy)-2-methylpropan-1-amine.
What is the SMILES notation for 3-(2-cyclopropylethoxy)-2-methylpropan-1-amine?
The canonical SMILES for 3-(2-cyclopropylethoxy)-2-methylpropan-1-amine is CC(CN)COCCC1CC1.
What is the InChIKey of 3-(2-cyclopropylethoxy)-2-methylpropan-1-amine?
The InChIKey is XYCLQYNIIZJNOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-8(6-10)7-11-5-4-9-2-3-9/h8-9H,2-7,10H2,1H3.
What are the key properties of 3-(2-cyclopropylethoxy)-2-methylpropan-1-amine?
3-(2-cyclopropylethoxy)-2-methylpropan-1-amine has a molecular weight of 157.26 g/mol, XLogP of 1.40, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-cyclopropylethoxy)-2-methylpropan-1-amine is sourced from PubChem (CID 106203362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).