N-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine

C12H26N2O — CID 62512388

IUPACN-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine
SMILESCOCC(C)N1CCC(CNC(C)C)C1
InChIInChI=1S/C12H26N2O/c1-10(2)13-7-12-5-6-14(8-12)11(3)9-15-4/h10-13H,5-9H2,1-4H3
InChIKeyFYDXKRAWXHDVBX-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.34
Rot. Bonds6

About N-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine

N-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine (PubChem CID 62512388) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine
PubChem CID62512388
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine
SMILESCOCC(C)N1CCC(CNC(C)C)C1
InChIInChI=1S/C12H26N2O/c1-10(2)13-7-12-5-6-14(8-12)11(3)9-15-4/h10-13H,5-9H2,1-4H3
InChIKeyFYDXKRAWXHDVBX-UHFFFAOYSA-N
XLogP1.34
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]ethanamine
CID 114802612
N-[[1-(1-cyclohexylpropyl)pyrrolidin-3-yl]methyl]propan-2-amine
CID 62523661
N-[(1-heptan-2-ylpiperidin-3-yl)methyl]propan-2-amine
CID 80558125
N-[[1-(3-methoxy-2,2-dimethylcyclobutyl)pyrrolidin-3-yl]methyl]propan-2-amine
CID 114119490
N-methyl-1-(1-pentan-2-ylpyrrolidin-3-yl)methanamine
CID 62511893
N-[[1-[3-(2-methoxyethoxy)propyl]piperidin-4-yl]methyl]propan-2-amine
CID 103410145
2-[3-(methoxymethyl)pyrrolidin-1-yl]-N-propan-2-ylpentan-1-amine
CID 83055159
N-[(1-cyclopentylpiperidin-4-yl)methyl]propan-2-amine
CID 63847367
N-[[1-(2-methoxycyclopentyl)pyrrolidin-3-yl]methyl]propan-2-amine
CID 62511985
N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pentan-3-amine
CID 61208503
N-[(1-cyclooctylpyrrolidin-3-yl)methyl]propan-2-amine
CID 55083195
4-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine
CID 64705792

Frequently Asked Questions

What is the IUPAC name of N-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine?
The IUPAC name of N-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine (CID 62512388) is N-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine is COCC(C)N1CCC(CNC(C)C)C1.
What is the InChIKey of N-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine?
The InChIKey is FYDXKRAWXHDVBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-10(2)13-7-12-5-6-14(8-12)11(3)9-15-4/h10-13H,5-9H2,1-4H3.
What are the key properties of N-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine?
N-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine has a molecular weight of 214.35 g/mol, XLogP of 1.34, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(1-methoxypropan-2-yl)pyrrolidin-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 62512388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).