N-(3-methoxypropyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide

C12H25N3O2 — CID 63301691

IUPACN-(3-methoxypropyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide
SMILESCOCCCNC(=O)C(C)N(C)C1CCNC1
InChIInChI=1S/C12H25N3O2/c1-10(12(16)14-6-4-8-17-3)15(2)11-5-7-13-9-11/h10-11,13H,4-9H2,1-3H3,(H,14,16)
InChIKeyDOOMXAQVABYDRE-UHFFFAOYSA-N
MW243.35 g/mol
LogP-0.18
Rot. Bonds7

About N-(3-methoxypropyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide

N-(3-methoxypropyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide (PubChem CID 63301691) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is N-(3-methoxypropyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide
PubChem CID63301691
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC NameN-(3-methoxypropyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide
SMILESCOCCCNC(=O)C(C)N(C)C1CCNC1
InChIInChI=1S/C12H25N3O2/c1-10(12(16)14-6-4-8-17-3)15(2)11-5-7-13-9-11/h10-11,13H,4-9H2,1-3H3,(H,14,16)
InChIKeyDOOMXAQVABYDRE-UHFFFAOYSA-N
XLogP-0.18
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 5-0.18
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-carbamoyl-2-[methyl(pyrrolidin-3-yl)amino]propanamide
CID 63301604
N-ethyl-2-[methyl(piperidin-4-yl)amino]propanamide
CID 43607766
N-(methylcarbamoyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide
CID 63301559
ethyl 2-[methyl(pyrrolidin-3-yl)amino]propanoate
CID 63301878
2-[8-azabicyclo[3.2.1]octan-3-yl(methyl)amino]-N-(2-methoxyethyl)propanamide
CID 61230707
N-(2-methoxyethyl)-2-[methyl-[4-(methylamino)cyclohexyl]amino]propanamide
CID 79122216
methyl 2-methyl-3-[methyl(pyrrolidin-3-yl)amino]butanoate
CID 79414659
N-methyl-2-[methyl(piperidin-3-yl)amino]propanamide
CID 63643925
N-(3-methoxypropyl)-2-[piperidin-3-yl(propyl)amino]acetamide
CID 63637518
2-[cyclopropyl(piperidin-2-ylmethyl)amino]-N-(3-methoxypropyl)propanamide
CID 106631734
N-(2-methoxyethyl)-2-pyrrolidin-3-yloxypropanamide
CID 62327217
N-tert-butyl-2-[methyl(piperidin-3-yl)amino]propanamide
CID 63644074

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide?
The IUPAC name of N-(3-methoxypropyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide (CID 63301691) is N-(3-methoxypropyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide.
What is the SMILES notation for N-(3-methoxypropyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide?
The canonical SMILES for N-(3-methoxypropyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide is COCCCNC(=O)C(C)N(C)C1CCNC1.
What is the InChIKey of N-(3-methoxypropyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide?
The InChIKey is DOOMXAQVABYDRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-10(12(16)14-6-4-8-17-3)15(2)11-5-7-13-9-11/h10-11,13H,4-9H2,1-3H3,(H,14,16).
What are the key properties of N-(3-methoxypropyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide?
N-(3-methoxypropyl)-2-[methyl(pyrrolidin-3-yl)amino]propanamide has a molecular weight of 243.35 g/mol, XLogP of -0.18, 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-[methyl(pyrrolidin-3-yl)amino]propanamide is sourced from PubChem (CID 63301691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).