N-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide

C12H24N2O3 — CID 43610209

IUPACN-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide
SMILESCOCCCNC(=O)C(C)NC1CCOCC1
InChIInChI=1S/C12H24N2O3/c1-10(12(15)13-6-3-7-16-2)14-11-4-8-17-9-5-11/h10-11,14H,3-9H2,1-2H3,(H,13,15)
InChIKeyOZIVSWSWESEMSM-UHFFFAOYSA-N
MW244.33 g/mol
LogP0.30
Rot. Bonds7

About N-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide

N-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide (PubChem CID 43610209) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is N-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide
PubChem CID43610209
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC NameN-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide
SMILESCOCCCNC(=O)C(C)NC1CCOCC1
InChIInChI=1S/C12H24N2O3/c1-10(12(15)13-6-3-7-16-2)14-11-4-8-17-9-5-11/h10-11,14H,3-9H2,1-2H3,(H,13,15)
InChIKeyOZIVSWSWESEMSM-UHFFFAOYSA-N
XLogP0.30
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-methoxypropyl)-2-[(1-propylpiperidin-4-yl)amino]propanamide
CID 60722361
N-(3-methoxypropyl)-2-[(2-methylcyclopropyl)amino]propanamide
CID 62398122
N-(3-methoxypropyl)-2-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propanamide
CID 60719611
2-[[(1S)-1-cyclopentylethyl]amino]-N-(3-methoxypropyl)propanamide
CID 81395208
2-[[(1R)-1-cyclopentylethyl]amino]-N-(3-methoxypropyl)propanamide
CID 81394890
N-(3-methoxypropyl)-2-[(4-methyloxan-4-yl)methylamino]propanamide
CID 103742237
N-(3-methoxypropyl)-2-[(4-methylcyclohexyl)methylamino]propanamide
CID 61490757
N-(3-methoxypropyl)-2-[2-(oxan-2-yl)ethylamino]propanamide
CID 103983559
N-(2-methoxyethyl)-2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]propanamide
CID 115574010
N-(3-methoxypropyl)morpholine-4-carboxamide
CID 3136313
1-(3-methoxypropyl)-3-[1-(oxan-4-yl)ethyl]thiourea
CID 103767959
N-butyl-2-(oxan-3-ylamino)propanamide
CID 63363455

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide?
The IUPAC name of N-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide (CID 43610209) is N-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide.
What is the SMILES notation for N-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide?
The canonical SMILES for N-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide is COCCCNC(=O)C(C)NC1CCOCC1.
What is the InChIKey of N-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide?
The InChIKey is OZIVSWSWESEMSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-10(12(15)13-6-3-7-16-2)14-11-4-8-17-9-5-11/h10-11,14H,3-9H2,1-2H3,(H,13,15).
What are the key properties of N-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide?
N-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide has a molecular weight of 244.33 g/mol, XLogP of 0.30, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-2-(oxan-4-ylamino)propanamide is sourced from PubChem (CID 43610209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).