N-(cyclopropylmethyl)-2,2-diethoxy-N-methylethanamine

C11H23NO2 — CID 63618697

IUPACN-(cyclopropylmethyl)-2,2-diethoxy-N-methylethanamine
SMILESCCOC(CN(C)CC1CC1)OCC
InChIInChI=1S/C11H23NO2/c1-4-13-11(14-5-2)9-12(3)8-10-6-7-10/h10-11H,4-9H2,1-3H3
InChIKeyUOAZWMDXQLZSPG-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.73
Rot. Bonds8

About N-(cyclopropylmethyl)-2,2-diethoxy-N-methylethanamine

N-(cyclopropylmethyl)-2,2-diethoxy-N-methylethanamine (PubChem CID 63618697) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2,2-diethoxy-N-methylethanamine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2,2-diethoxy-N-methylethanamine
PubChem CID63618697
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC NameN-(cyclopropylmethyl)-2,2-diethoxy-N-methylethanamine
SMILESCCOC(CN(C)CC1CC1)OCC
InChIInChI=1S/C11H23NO2/c1-4-13-11(14-5-2)9-12(3)8-10-6-7-10/h10-11H,4-9H2,1-3H3
InChIKeyUOAZWMDXQLZSPG-UHFFFAOYSA-N
XLogP1.73
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.73
H-Bond Donors ≤ 50
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

N-(cyclopropylmethyl)-N-(2,2-diethoxyethyl)propan-2-amine
CID 63619184
N-(cyclopentylmethyl)-2,2-dimethoxy-N-methylethanamine
CID 66222142
3,3-diethoxy-N-methyl-N-(oxan-4-ylmethyl)propan-1-amine
CID 63712799
1-N-(cyclopropylmethyl)-1-N,3-dimethylpentane-1,2-diamine
CID 60985406
(2S)-1-N-(cyclopropylmethyl)-1-N-methylpropane-1,2-diamine
CID 93424361
2-chloro-N-(cyclopropylmethyl)-N-methylpropan-1-amine
CID 63387305
1-N-(cyclopropylmethyl)-1-N-methylpropane-1,2-diamine
CID 60984207
N-(2,2-diethoxyethyl)-N,3-dimethylbutan-1-amine
CID 63619021
1-N-(cyclopropylmethyl)-1-N,3-dimethylbutane-1,2-diamine
CID 60985776
1-N-(cyclopropylmethyl)-1-N-methylhexane-1,2-diamine
CID 60984085
1-cyclopropyl-N'-(cyclopropylmethyl)-N-ethyl-N'-methylethane-1,2-diamine
CID 63913659
2-ethoxy-N'-methyl-N'-[(1-methylpyrrolidin-3-yl)methyl]propane-1,3-diamine
CID 63276105

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2,2-diethoxy-N-methylethanamine?
The IUPAC name of N-(cyclopropylmethyl)-2,2-diethoxy-N-methylethanamine (CID 63618697) is N-(cyclopropylmethyl)-2,2-diethoxy-N-methylethanamine.
What is the SMILES notation for N-(cyclopropylmethyl)-2,2-diethoxy-N-methylethanamine?
The canonical SMILES for N-(cyclopropylmethyl)-2,2-diethoxy-N-methylethanamine is CCOC(CN(C)CC1CC1)OCC.
What is the InChIKey of N-(cyclopropylmethyl)-2,2-diethoxy-N-methylethanamine?
The InChIKey is UOAZWMDXQLZSPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-4-13-11(14-5-2)9-12(3)8-10-6-7-10/h10-11H,4-9H2,1-3H3.
What are the key properties of N-(cyclopropylmethyl)-2,2-diethoxy-N-methylethanamine?
N-(cyclopropylmethyl)-2,2-diethoxy-N-methylethanamine has a molecular weight of 201.31 g/mol, XLogP of 1.73, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2,2-diethoxy-N-methylethanamine is sourced from PubChem (CID 63618697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).