2-(3-methoxypropylamino)-N-pentylpropanamide

C12H26N2O2 — CID 43131874

IUPAC2-(3-methoxypropylamino)-N-pentylpropanamide
SMILESCCCCCNC(=O)C(C)NCCCOC
InChIInChI=1S/C12H26N2O2/c1-4-5-6-8-14-12(15)11(2)13-9-7-10-16-3/h11,13H,4-10H2,1-3H3,(H,14,15)
InChIKeyZURYMQSYAQSWQW-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.31
Rot. Bonds10

About 2-(3-methoxypropylamino)-N-pentylpropanamide

2-(3-methoxypropylamino)-N-pentylpropanamide (PubChem CID 43131874) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-(3-methoxypropylamino)-N-pentylpropanamide.

Molecular Properties

Compound Name2-(3-methoxypropylamino)-N-pentylpropanamide
PubChem CID43131874
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name2-(3-methoxypropylamino)-N-pentylpropanamide
SMILESCCCCCNC(=O)C(C)NCCCOC
InChIInChI=1S/C12H26N2O2/c1-4-5-6-8-14-12(15)11(2)13-9-7-10-16-3/h11,13H,4-10H2,1-3H3,(H,14,15)
InChIKeyZURYMQSYAQSWQW-UHFFFAOYSA-N
XLogP1.31
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyethyl)-2-(nonylamino)propanamide
CID 115574851
N-(3-methoxypropyl)-2-(3-propoxypropylamino)propanamide
CID 82943912
N-(3-methoxypropyl)-2-(5-methylsulfanylpentylamino)propanamide
CID 114127252
methyl 3-[[1-(3-methoxypropylamino)-1-oxopropan-2-yl]amino]propanoate
CID 60719502
2-[[1-oxo-1-(pentylamino)propan-2-yl]amino]ethyl carbamate
CID 83210164
2-[2-[di(propan-2-yl)amino]ethylamino]-N-(3-methoxypropyl)propanamide
CID 43113238
N-butyl-2-[(3-hydroxy-4-methoxybutyl)amino]propanamide
CID 106246633
N-butyl-2-[[2-(2-methoxyethylamino)-2-oxoethyl]amino]propanamide
CID 112683886
N-pentyl-2-(2-phenoxyethylamino)propanamide
CID 60720089
2-[(3-amino-3-oxopropyl)amino]-N-pentylpropanamide
CID 43553504
N-(3-methoxypropyl)-2-(2-methylsulfanylpropylamino)propanamide
CID 115760932
2-(3-ethylsulfonylpropylamino)-N-(2-methoxyethyl)propanamide
CID 113407022

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxypropylamino)-N-pentylpropanamide?
The IUPAC name of 2-(3-methoxypropylamino)-N-pentylpropanamide (CID 43131874) is 2-(3-methoxypropylamino)-N-pentylpropanamide.
What is the SMILES notation for 2-(3-methoxypropylamino)-N-pentylpropanamide?
The canonical SMILES for 2-(3-methoxypropylamino)-N-pentylpropanamide is CCCCCNC(=O)C(C)NCCCOC.
What is the InChIKey of 2-(3-methoxypropylamino)-N-pentylpropanamide?
The InChIKey is ZURYMQSYAQSWQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-4-5-6-8-14-12(15)11(2)13-9-7-10-16-3/h11,13H,4-10H2,1-3H3,(H,14,15).
What are the key properties of 2-(3-methoxypropylamino)-N-pentylpropanamide?
2-(3-methoxypropylamino)-N-pentylpropanamide has a molecular weight of 230.35 g/mol, XLogP of 1.31, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxypropylamino)-N-pentylpropanamide is sourced from PubChem (CID 43131874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).