N-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide

C11H22N2O2 — CID 63142401

IUPACN-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide
SMILESCOCCCN(C)C(=O)C1(C)CCNC1
InChIInChI=1S/C11H22N2O2/c1-11(5-6-12-9-11)10(14)13(2)7-4-8-15-3/h12H,4-9H2,1-3H3
InChIKeyAAXNUFAGVIBFBJ-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.48
Rot. Bonds5

About N-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide

N-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide (PubChem CID 63142401) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide
PubChem CID63142401
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide
SMILESCOCCCN(C)C(=O)C1(C)CCNC1
InChIInChI=1S/C11H22N2O2/c1-11(5-6-12-9-11)10(14)13(2)7-4-8-15-3/h12H,4-9H2,1-3H3
InChIKeyAAXNUFAGVIBFBJ-UHFFFAOYSA-N
XLogP0.48
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.48
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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Related Compounds

methyl 4-[methyl-(3-methylpyrrolidine-3-carbonyl)amino]butanoate
CID 63143846
N-cyclopropyl-N-(2-methoxyethyl)-3-methylpyrrolidine-3-carboxamide
CID 63143850
N-[2-(3,5-dimethylphenoxy)ethyl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 63139967
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-3-methylpyrrolidine-3-carboxamide
CID 55166694
N,N-bis(2-methoxyethyl)-3-methylpiperidine-3-carboxamide
CID 63130592
N-(3-methoxypropyl)-3-methylpyrrolidine-3-carboxamide
CID 63138395
1-amino-N-(3-methoxypropyl)-N-methylcyclohexane-1-carboxamide
CID 63008768
N,N-bis(2-methoxyethyl)-4-methylpiperidine-4-carboxamide
CID 55179285
N-(3-methoxypropyl)-N-methylpiperazine-1-carboxamide
CID 62983933
N-(cyclopentylmethyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 63657339
methyl 2-[methyl-(3-methylpiperidine-3-carbonyl)amino]acetate
CID 63131941
N-ethyl-N-(2-methoxyethyl)-3-methylpiperidine-3-carboxamide
CID 63135216

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide?
The IUPAC name of N-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide (CID 63142401) is N-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide is COCCCN(C)C(=O)C1(C)CCNC1.
What is the InChIKey of N-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide?
The InChIKey is AAXNUFAGVIBFBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-11(5-6-12-9-11)10(14)13(2)7-4-8-15-3/h12H,4-9H2,1-3H3.
What are the key properties of N-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide?
N-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 0.48, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-N,3-dimethylpyrrolidine-3-carboxamide is sourced from PubChem (CID 63142401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).