N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methyloxolan-3-amine

C12H24N2O — CID 115335792

IUPACN-[(1-ethylpyrrolidin-3-yl)methyl]-2-methyloxolan-3-amine
SMILESCCN1CCC(CNC2CCOC2C)C1
InChIInChI=1S/C12H24N2O/c1-3-14-6-4-11(9-14)8-13-12-5-7-15-10(12)2/h10-13H,3-9H2,1-2H3
InChIKeySLDVMTLEWAVPDO-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.10
Rot. Bonds4

About N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methyloxolan-3-amine

N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methyloxolan-3-amine (PubChem CID 115335792) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methyloxolan-3-amine.

Molecular Properties

Compound NameN-[(1-ethylpyrrolidin-3-yl)methyl]-2-methyloxolan-3-amine
PubChem CID115335792
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-[(1-ethylpyrrolidin-3-yl)methyl]-2-methyloxolan-3-amine
SMILESCCN1CCC(CNC2CCOC2C)C1
InChIInChI=1S/C12H24N2O/c1-3-14-6-4-11(9-14)8-13-12-5-7-15-10(12)2/h10-13H,3-9H2,1-2H3
InChIKeySLDVMTLEWAVPDO-UHFFFAOYSA-N
XLogP1.10
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R,3S)-N-(cyclopropylmethyl)-2-methyloxolan-3-amine
CID 97358188
N-[(1-ethylpyrrolidin-3-yl)methyl]oxan-4-amine
CID 60855683
N-[(4-ethylcyclohexyl)methyl]-2-methyloxolan-3-amine
CID 115338207
2-[(1-ethylpyrrolidin-3-yl)methylamino]cyclohexan-1-ol
CID 60885885
trans-(1S,2S)-2-[(1-ethylpyrrolidin-3-yl)methylamino]cyclohexan-1-ol
CID 102731045
N-[(1-ethylpyrrolidin-3-yl)methyl]-2,4,4-trimethylcyclohexan-1-amine
CID 81297441
2-methyl-N-[(4-methylmorpholin-2-yl)methyl]oxolan-3-amine
CID 75525404
N-[(1-ethylpyrrolidin-3-yl)methyl]-2-propan-2-ylcyclohexan-1-amine
CID 81298398
4-N-[(1-ethylpyrrolidin-3-yl)methyl]cyclohexane-1,4-diamine
CID 79731283
2-[(1-ethylpyrrolidin-3-yl)methylamino]cycloheptane-1-carbonitrile
CID 62741870
(2R,3S)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-methyloxolane-3-sulfonamide
CID 129446480
N-[(1-ethylpyrrolidin-3-yl)methyl]pyrrolidin-3-amine
CID 79731365

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methyloxolan-3-amine?
The IUPAC name of N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methyloxolan-3-amine (CID 115335792) is N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methyloxolan-3-amine.
What is the SMILES notation for N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methyloxolan-3-amine?
The canonical SMILES for N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methyloxolan-3-amine is CCN1CCC(CNC2CCOC2C)C1.
What is the InChIKey of N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methyloxolan-3-amine?
The InChIKey is SLDVMTLEWAVPDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-3-14-6-4-11(9-14)8-13-12-5-7-15-10(12)2/h10-13H,3-9H2,1-2H3.
What are the key properties of N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methyloxolan-3-amine?
N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methyloxolan-3-amine has a molecular weight of 212.34 g/mol, XLogP of 1.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methyloxolan-3-amine is sourced from PubChem (CID 115335792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).