1-cyclopropyl-N-(2,2-dimethoxyethyl)propan-2-amine

C10H21NO2 — CID 63989699

IUPAC1-cyclopropyl-N-(2,2-dimethoxyethyl)propan-2-amine
SMILESCOC(CNC(C)CC1CC1)OC
InChIInChI=1S/C10H21NO2/c1-8(6-9-4-5-9)11-7-10(12-2)13-3/h8-11H,4-7H2,1-3H3
InChIKeyIFYHZTXLXQCQLG-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.38
Rot. Bonds7

About 1-cyclopropyl-N-(2,2-dimethoxyethyl)propan-2-amine

1-cyclopropyl-N-(2,2-dimethoxyethyl)propan-2-amine (PubChem CID 63989699) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 1-cyclopropyl-N-(2,2-dimethoxyethyl)propan-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-(2,2-dimethoxyethyl)propan-2-amine
PubChem CID63989699
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name1-cyclopropyl-N-(2,2-dimethoxyethyl)propan-2-amine
SMILESCOC(CNC(C)CC1CC1)OC
InChIInChI=1S/C10H21NO2/c1-8(6-9-4-5-9)11-7-10(12-2)13-3/h8-11H,4-7H2,1-3H3
InChIKeyIFYHZTXLXQCQLG-UHFFFAOYSA-N
XLogP1.38
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-cyclopropyl-N-(2,2-dicyclopropylethyl)propan-2-amine
CID 115724974
1-N-(1-cyclopropylpropan-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine
CID 115717048
N-(1-cyclopropylpropan-2-yl)-2-methyl-3-methylsulfanylpropan-1-amine
CID 115719687
4-(1-cyclopropylpropan-2-ylamino)-3-methylbutan-1-ol
CID 115725095
methyl 2-acetamido-3-(1-cyclopropylpropan-2-ylamino)propanoate
CID 103251173
N-(2,2-dimethoxyethyl)pentan-2-amine
CID 60816170
3-(1-cyclopropylpropan-2-ylamino)-N'-hydroxy-2-methylpropanimidamide
CID 77028693
N-[1-(1-ethylpiperidin-4-yl)ethyl]-2,2-dimethoxyethanamine
CID 60816961
1-cyclopropyl-N-(2,2-dimethoxyethyl)methanesulfonamide
CID 64987276
1-cyclopropyl-N-(3-cyclopropylpropyl)propan-2-amine
CID 115890825
ethyl 4-(1-cyclopropylpropan-2-ylamino)-3-hydroxybutanoate
CID 103251140
N-(1-cyclopropylpropan-2-yl)-2-pyrrolidin-1-ylbutan-1-amine
CID 115709200

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(2,2-dimethoxyethyl)propan-2-amine?
The IUPAC name of 1-cyclopropyl-N-(2,2-dimethoxyethyl)propan-2-amine (CID 63989699) is 1-cyclopropyl-N-(2,2-dimethoxyethyl)propan-2-amine.
What is the SMILES notation for 1-cyclopropyl-N-(2,2-dimethoxyethyl)propan-2-amine?
The canonical SMILES for 1-cyclopropyl-N-(2,2-dimethoxyethyl)propan-2-amine is COC(CNC(C)CC1CC1)OC.
What is the InChIKey of 1-cyclopropyl-N-(2,2-dimethoxyethyl)propan-2-amine?
The InChIKey is IFYHZTXLXQCQLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-8(6-9-4-5-9)11-7-10(12-2)13-3/h8-11H,4-7H2,1-3H3.
What are the key properties of 1-cyclopropyl-N-(2,2-dimethoxyethyl)propan-2-amine?
1-cyclopropyl-N-(2,2-dimethoxyethyl)propan-2-amine has a molecular weight of 187.28 g/mol, XLogP of 1.38, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(2,2-dimethoxyethyl)propan-2-amine is sourced from PubChem (CID 63989699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).