3-methoxy-N-pyrrolidin-2-ylpropanamide

C8H16N2O2 — CID 117126661

IUPAC3-methoxy-N-pyrrolidin-2-ylpropanamide
SMILESCOCCC(=O)NC1CCCN1
InChIInChI=1S/C8H16N2O2/c1-12-6-4-8(11)10-7-3-2-5-9-7/h7,9H,2-6H2,1H3,(H,10,11)
InChIKeySVRDAOPTECYGGY-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.15
Rot. Bonds4

About 3-methoxy-N-pyrrolidin-2-ylpropanamide

3-methoxy-N-pyrrolidin-2-ylpropanamide (PubChem CID 117126661) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 3-methoxy-N-pyrrolidin-2-ylpropanamide.

Molecular Properties

Compound Name3-methoxy-N-pyrrolidin-2-ylpropanamide
PubChem CID117126661
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name3-methoxy-N-pyrrolidin-2-ylpropanamide
SMILESCOCCC(=O)NC1CCCN1
InChIInChI=1S/C8H16N2O2/c1-12-6-4-8(11)10-7-3-2-5-9-7/h7,9H,2-6H2,1H3,(H,10,11)
InChIKeySVRDAOPTECYGGY-UHFFFAOYSA-N
XLogP-0.15
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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N-(8-azabicyclo[3.2.1]octan-3-yl)-3-methoxypropanamide
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N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)butanamide
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(2R)-N-methoxypyrrolidin-2-amine
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3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride
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N-butyl-3-methoxy-N-(pyrrolidin-2-ylmethyl)propanamide
CID 106612022
2-[2-methoxyethyl-[(2R)-pyrrolidine-2-carbonyl]amino]acetic acid
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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-pyrrolidin-2-ylpropanamide?
The IUPAC name of 3-methoxy-N-pyrrolidin-2-ylpropanamide (CID 117126661) is 3-methoxy-N-pyrrolidin-2-ylpropanamide.
What is the SMILES notation for 3-methoxy-N-pyrrolidin-2-ylpropanamide?
The canonical SMILES for 3-methoxy-N-pyrrolidin-2-ylpropanamide is COCCC(=O)NC1CCCN1.
What is the InChIKey of 3-methoxy-N-pyrrolidin-2-ylpropanamide?
The InChIKey is SVRDAOPTECYGGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-12-6-4-8(11)10-7-3-2-5-9-7/h7,9H,2-6H2,1H3,(H,10,11).
What are the key properties of 3-methoxy-N-pyrrolidin-2-ylpropanamide?
3-methoxy-N-pyrrolidin-2-ylpropanamide has a molecular weight of 172.23 g/mol, XLogP of -0.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-pyrrolidin-2-ylpropanamide is sourced from PubChem (CID 117126661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).