N-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide

C16H24N2O3 — CID 66264833

IUPACN-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide
SMILESCNC1COCC1C(=O)N(C)CCCOc1ccccc1
InChIInChI=1S/C16H24N2O3/c1-17-15-12-20-11-14(15)16(19)18(2)9-6-10-21-13-7-4-3-5-8-13/h3-5,7-8,14-15,17H,6,9-12H2,1-2H3
InChIKeyWOTVMBURHYQZOM-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.15
Rot. Bonds7

About N-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide

N-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide (PubChem CID 66264833) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide
PubChem CID66264833
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide
SMILESCNC1COCC1C(=O)N(C)CCCOc1ccccc1
InChIInChI=1S/C16H24N2O3/c1-17-15-12-20-11-14(15)16(19)18(2)9-6-10-21-13-7-4-3-5-8-13/h3-5,7-8,14-15,17H,6,9-12H2,1-2H3
InChIKeyWOTVMBURHYQZOM-UHFFFAOYSA-N
XLogP1.15
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-4-(methylamino)-N-(2-phenylethyl)oxolane-3-carboxamide
CID 66264836
N-methyl-4-(methylamino)-N-(2-pyridin-2-ylethyl)oxolane-3-carboxamide
CID 66267541
2-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide
CID 64824766
4-[methyl(3-phenoxypropyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 120672844
N-methyl-N-(3-phenoxypropyl)acetamide
CID 60757278
cis-(1S,3R)-3-hydroxy-N-methyl-N-(3-phenoxypropyl)cyclohexane-1-carboxamide
CID 91777791
N,4-dimethyl-N-(2-phenoxyethyl)pyrrolidine-3-carboxamide
CID 63714789
N-[(4-chlorophenyl)methyl]-N-methyl-4-(methylamino)oxolane-3-carboxamide
CID 66267194
4-(4-phenoxybutanoylamino)oxolane-3-carboxylic acid
CID 66221172
N-[(4-cyanophenyl)methyl]-N-methyl-4-(methylamino)oxolane-3-carboxamide
CID 66266207
trans-(1R,3R)-3-amino-N-methyl-N-(3-phenoxypropyl)cyclopentane-1-carboxamide
CID 97123271
(4S)-N,1-dimethyl-2-oxo-N-(3-phenoxypropyl)piperidine-4-carboxamide
CID 94168581

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide?
The IUPAC name of N-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide (CID 66264833) is N-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide.
What is the SMILES notation for N-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide?
The canonical SMILES for N-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide is CNC1COCC1C(=O)N(C)CCCOc1ccccc1.
What is the InChIKey of N-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide?
The InChIKey is WOTVMBURHYQZOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-17-15-12-20-11-14(15)16(19)18(2)9-6-10-21-13-7-4-3-5-8-13/h3-5,7-8,14-15,17H,6,9-12H2,1-2H3.
What are the key properties of N-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide?
N-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 1.15, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(methylamino)-N-(3-phenoxypropyl)oxolane-3-carboxamide is sourced from PubChem (CID 66264833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).