1-(dimethylamino)cyclopropane-1-carbaldehyde;methanamine

C7H16N2O — CID 153399897

IUPAC1-(dimethylamino)cyclopropane-1-carbaldehyde;methanamine
SMILESCN.CN(C)C1(C=O)CC1
InChIInChI=1S/C6H11NO.CH5N/c1-7(2)6(5-8)3-4-6;1-2/h5H,3-4H2,1-2H3;2H2,1H3
InChIKeyIFGXGGQWDXVDTH-UHFFFAOYSA-N
MW144.22 g/mol
LogP-0.15
Rot. Bonds2

About 1-(dimethylamino)cyclopropane-1-carbaldehyde;methanamine

1-(dimethylamino)cyclopropane-1-carbaldehyde;methanamine (PubChem CID 153399897) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is 1-(dimethylamino)cyclopropane-1-carbaldehyde;methanamine.

Molecular Properties

Compound Name1-(dimethylamino)cyclopropane-1-carbaldehyde;methanamine
PubChem CID153399897
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name1-(dimethylamino)cyclopropane-1-carbaldehyde;methanamine
SMILESCN.CN(C)C1(C=O)CC1
InChIInChI=1S/C6H11NO.CH5N/c1-7(2)6(5-8)3-4-6;1-2/h5H,3-4H2,1-2H3;2H2,1H3
InChIKeyIFGXGGQWDXVDTH-UHFFFAOYSA-N
XLogP-0.15
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-(dimethylamino)oxane-4-carbaldehyde
CID 115012260
benzyl N-(1-formylcyclopropyl)-N-methylcarbamate
CID 129285103
1-[4-amino-2-(dimethylamino)phenyl]cyclopropane-1-carbaldehyde
CID 176997282
1-(4-methylcyclohexyl)cyclobutane-1-carbaldehyde
CID 130700511
1-aminocyclohexane-1-carbaldehyde;ethane
CID 145148133
1-aminocyclopentane-1-carbaldehyde;methanol
CID 142267207
1-propan-2-ylcycloheptane-1-carbaldehyde
CID 130026144
4-[1-(dimethylamino)cyclopropyl]benzaldehyde
CID 115017883
N-methyl-N-(1-methylcyclohexyl)formamide
CID 175037555
1-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclopentane-1-carbaldehyde
CID 62275706
1-tert-butylcyclopropane-1-carbaldehyde
CID 12542135
CID 159352431
CID 159352431

Frequently Asked Questions

What is the IUPAC name of 1-(dimethylamino)cyclopropane-1-carbaldehyde;methanamine?
The IUPAC name of 1-(dimethylamino)cyclopropane-1-carbaldehyde;methanamine (CID 153399897) is 1-(dimethylamino)cyclopropane-1-carbaldehyde;methanamine.
What is the SMILES notation for 1-(dimethylamino)cyclopropane-1-carbaldehyde;methanamine?
The canonical SMILES for 1-(dimethylamino)cyclopropane-1-carbaldehyde;methanamine is CN.CN(C)C1(C=O)CC1.
What is the InChIKey of 1-(dimethylamino)cyclopropane-1-carbaldehyde;methanamine?
The InChIKey is IFGXGGQWDXVDTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO.CH5N/c1-7(2)6(5-8)3-4-6;1-2/h5H,3-4H2,1-2H3;2H2,1H3.
What are the key properties of 1-(dimethylamino)cyclopropane-1-carbaldehyde;methanamine?
1-(dimethylamino)cyclopropane-1-carbaldehyde;methanamine has a molecular weight of 144.22 g/mol, XLogP of -0.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylamino)cyclopropane-1-carbaldehyde;methanamine is sourced from PubChem (CID 153399897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).