N-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide

C14H28N2O3 — CID 103742237

IUPACN-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide
SMILESCOCCCNC(=O)C(C)NCC1(C)CCOCC1
InChIInChI=1S/C14H28N2O3/c1-12(13(17)15-7-4-8-18-3)16-11-14(2)5-9-19-10-6-14/h12,16H,4-11H2,1-3H3,(H,15,17)
InChIKeyZPTCUUHPCHQSSK-UHFFFAOYSA-N
MW272.39 g/mol
LogP0.93
Rot. Bonds8

About N-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide

N-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide (PubChem CID 103742237) has the molecular formula C14H28N2O3 and a molecular weight of 272.39 g/mol. Its IUPAC name is N-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide
PubChem CID103742237
Molecular FormulaC14H28N2O3
Molecular Weight272.39 g/mol
Exact Mass272.21
IUPAC NameN-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide
SMILESCOCCCNC(=O)C(C)NCC1(C)CCOCC1
InChIInChI=1S/C14H28N2O3/c1-12(13(17)15-7-4-8-18-3)16-11-14(2)5-9-19-10-6-14/h12,16H,4-11H2,1-3H3,(H,15,17)
InChIKeyZPTCUUHPCHQSSK-UHFFFAOYSA-N
XLogP0.93
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-methoxypropyl)-2-[(1-methylcyclopropyl)methylamino]propanamide
CID 103724771
2-[(1,4-dimethylpiperidin-4-yl)methylamino]-N-(3-methoxypropyl)propanamide
CID 107163797
2-[[1-(hydroxymethyl)cyclohexyl]methylamino]-N-(3-methoxypropyl)propanamide
CID 103966438
N-butyl-2-[(4-hydroxyoxan-4-yl)methylamino]propanamide
CID 81131394
N-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide
CID 43610209
methyl 3-[[1-(3-methoxypropylamino)-1-oxopropan-2-yl]amino]propanoate
CID 60719502
5-methoxy-N-[(4-methyloxan-4-yl)methyl]pentan-1-amine
CID 104586141
2-(3-methoxypropylamino)-N-pentylpropanamide
CID 43131874
2-[(1-hydroxycyclopentyl)methylamino]-N-(2-methoxyethyl)propanamide
CID 65109266
2-[(1-hydroxycycloheptyl)methylamino]-N-(2-methoxyethyl)propanamide
CID 65123309
N-(3-methoxypropyl)-2-(3-propoxypropylamino)propanamide
CID 82943912
2-[2-[di(propan-2-yl)amino]ethylamino]-N-(3-methoxypropyl)propanamide
CID 43113238

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide?
The IUPAC name of N-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide (CID 103742237) is N-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide.
What is the SMILES notation for N-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide?
The canonical SMILES for N-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide is COCCCNC(=O)C(C)NCC1(C)CCOCC1.
What is the InChIKey of N-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide?
The InChIKey is ZPTCUUHPCHQSSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O3/c1-12(13(17)15-7-4-8-18-3)16-11-14(2)5-9-19-10-6-14/h12,16H,4-11H2,1-3H3,(H,15,17).
What are the key properties of N-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide?
N-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide has a molecular weight of 272.39 g/mol, XLogP of 0.93, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide is sourced from PubChem (CID 103742237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).