1-(methoxymethyl)-N-[3-(N-methylanilino)propyl]cyclopropane-1-carboxamide

C16H24N2O2 — CID 74241887

IUPAC1-(methoxymethyl)-N-[3-(N-methylanilino)propyl]cyclopropane-1-carboxamide
SMILESCOCC1(C(=O)NCCCN(C)c2ccccc2)CC1
InChIInChI=1S/C16H24N2O2/c1-18(14-7-4-3-5-8-14)12-6-11-17-15(19)16(9-10-16)13-20-2/h3-5,7-8H,6,9-13H2,1-2H3,(H,17,19)
InChIKeyUVBKLJLNHKXWKI-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.06
Rot. Bonds8

About 1-(methoxymethyl)-N-[3-(N-methylanilino)propyl]cyclopropane-1-carboxamide

1-(methoxymethyl)-N-[3-(N-methylanilino)propyl]cyclopropane-1-carboxamide (PubChem CID 74241887) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-(methoxymethyl)-N-[3-(N-methylanilino)propyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(methoxymethyl)-N-[3-(N-methylanilino)propyl]cyclopropane-1-carboxamide
PubChem CID74241887
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name1-(methoxymethyl)-N-[3-(N-methylanilino)propyl]cyclopropane-1-carboxamide
SMILESCOCC1(C(=O)NCCCN(C)c2ccccc2)CC1
InChIInChI=1S/C16H24N2O2/c1-18(14-7-4-3-5-8-14)12-6-11-17-15(19)16(9-10-16)13-20-2/h3-5,7-8H,6,9-13H2,1-2H3,(H,17,19)
InChIKeyUVBKLJLNHKXWKI-UHFFFAOYSA-N
XLogP2.06
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)-N-[3-(N-methylanilino)propyl]cyclopropane-1-carboxamide?
The IUPAC name of 1-(methoxymethyl)-N-[3-(N-methylanilino)propyl]cyclopropane-1-carboxamide (CID 74241887) is 1-(methoxymethyl)-N-[3-(N-methylanilino)propyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(methoxymethyl)-N-[3-(N-methylanilino)propyl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-(methoxymethyl)-N-[3-(N-methylanilino)propyl]cyclopropane-1-carboxamide is COCC1(C(=O)NCCCN(C)c2ccccc2)CC1.
What is the InChIKey of 1-(methoxymethyl)-N-[3-(N-methylanilino)propyl]cyclopropane-1-carboxamide?
The InChIKey is UVBKLJLNHKXWKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-18(14-7-4-3-5-8-14)12-6-11-17-15(19)16(9-10-16)13-20-2/h3-5,7-8H,6,9-13H2,1-2H3,(H,17,19).
What are the key properties of 1-(methoxymethyl)-N-[3-(N-methylanilino)propyl]cyclopropane-1-carboxamide?
1-(methoxymethyl)-N-[3-(N-methylanilino)propyl]cyclopropane-1-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.06, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)-N-[3-(N-methylanilino)propyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 74241887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).