N-methyl-2-(oxolan-2-ylmethoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride

C13H25ClN2O3 — CID 119552771

IUPACN-methyl-2-(oxolan-2-ylmethoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride
SMILESCC(OCC1CCCO1)C(=O)N(C)C1CCNC1.Cl
InChIInChI=1S/C13H24N2O3.ClH/c1-10(18-9-12-4-3-7-17-12)13(16)15(2)11-5-6-14-8-11;/h10-12,14H,3-9H2,1-2H3;1H
InChIKeyCRKNJSUEPUHKLQ-UHFFFAOYSA-N
MW292.81 g/mol
LogP0.81
Rot. Bonds5

About N-methyl-2-(oxolan-2-ylmethoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride

N-methyl-2-(oxolan-2-ylmethoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride (PubChem CID 119552771) has the molecular formula C13H25ClN2O3 and a molecular weight of 292.81 g/mol. Its IUPAC name is N-methyl-2-(oxolan-2-ylmethoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-2-(oxolan-2-ylmethoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride
PubChem CID119552771
Molecular FormulaC13H25ClN2O3
Molecular Weight292.81 g/mol
Exact Mass292.16
IUPAC NameN-methyl-2-(oxolan-2-ylmethoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride
SMILESCC(OCC1CCCO1)C(=O)N(C)C1CCNC1.Cl
InChIInChI=1S/C13H24N2O3.ClH/c1-10(18-9-12-4-3-7-17-12)13(16)15(2)11-5-6-14-8-11;/h10-12,14H,3-9H2,1-2H3;1H
InChIKeyCRKNJSUEPUHKLQ-UHFFFAOYSA-N
XLogP0.81
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.81
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-ethoxyethoxy)-N-methyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119552841
2-[cyclopropyl-[2-(oxolan-2-ylmethoxy)propanoyl]amino]propanoic acid
CID 119203382
2-ethoxy-N-methyl-N-piperidin-4-ylpropanamide
CID 119444012
2-(oxan-2-ylmethoxy)-N-piperidin-3-ylpropanamide
CID 119429154
N-methyl-3-(oxolan-2-ylmethoxy)-N-piperidin-4-ylpropanamide
CID 119441358
2-(oxolan-2-ylmethoxy)-N-(piperidin-3-ylmethyl)propanamide
CID 119462659
2-(oxolan-2-ylmethoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride
CID 119557645
3-[methyl-[2-(oxan-2-ylmethoxy)propanoyl]amino]propanoic acid
CID 119232781
3-[2-(oxolan-2-ylmethoxy)propanoyl-propan-2-ylamino]propanoic acid
CID 119207645
oxolan-2-ylmethyl pyrrolidine-3-carboxylate
CID 63031488
1-[2-(hydroxymethyl)piperazin-1-yl]-2-(oxan-2-ylmethoxy)propan-1-one
CID 167981032
N-(azetidin-3-yl)-N-methyl-3-(oxolan-2-yl)propanamide
CID 66187540

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(oxolan-2-ylmethoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride?
The IUPAC name of N-methyl-2-(oxolan-2-ylmethoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride (CID 119552771) is N-methyl-2-(oxolan-2-ylmethoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride.
What is the SMILES notation for N-methyl-2-(oxolan-2-ylmethoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride?
The canonical SMILES for N-methyl-2-(oxolan-2-ylmethoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride is CC(OCC1CCCO1)C(=O)N(C)C1CCNC1.Cl.
What is the InChIKey of N-methyl-2-(oxolan-2-ylmethoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride?
The InChIKey is CRKNJSUEPUHKLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3.ClH/c1-10(18-9-12-4-3-7-17-12)13(16)15(2)11-5-6-14-8-11;/h10-12,14H,3-9H2,1-2H3;1H.
What are the key properties of N-methyl-2-(oxolan-2-ylmethoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride?
N-methyl-2-(oxolan-2-ylmethoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride has a molecular weight of 292.81 g/mol, XLogP of 0.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(oxolan-2-ylmethoxy)-N-pyrrolidin-3-ylpropanamide;hydrochloride is sourced from PubChem (CID 119552771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).