N-[(1-ethylpyrrolidin-2-yl)methyl]-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)methanamine

C17H28N2O2 — CID 43818363

IUPACN-[(1-ethylpyrrolidin-2-yl)methyl]-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)methanamine
SMILESCCN1CCCC1CN(Cc1ccco1)CC1CCOC1
InChIInChI=1S/C17H28N2O2/c1-2-19-8-3-5-16(19)12-18(11-15-7-10-20-14-15)13-17-6-4-9-21-17/h4,6,9,15-16H,2-3,5,7-8,10-14H2,1H3
InChIKeyRLOADQGYRKPQCR-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.60
Rot. Bonds7

About N-[(1-ethylpyrrolidin-2-yl)methyl]-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)methanamine

N-[(1-ethylpyrrolidin-2-yl)methyl]-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)methanamine (PubChem CID 43818363) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is N-[(1-ethylpyrrolidin-2-yl)methyl]-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)methanamine.

Molecular Properties

Compound NameN-[(1-ethylpyrrolidin-2-yl)methyl]-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)methanamine
PubChem CID43818363
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC NameN-[(1-ethylpyrrolidin-2-yl)methyl]-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)methanamine
SMILESCCN1CCCC1CN(Cc1ccco1)CC1CCOC1
InChIInChI=1S/C17H28N2O2/c1-2-19-8-3-5-16(19)12-18(11-15-7-10-20-14-15)13-17-6-4-9-21-17/h4,6,9,15-16H,2-3,5,7-8,10-14H2,1H3
InChIKeyRLOADQGYRKPQCR-UHFFFAOYSA-N
XLogP2.60
TPSA28.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-ethylpyrrolidin-2-yl)-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)methanamine
CID 46961939
N-[(1-ethylpyrrolidin-3-yl)methyl]-N-(furan-2-ylmethyl)ethanamine
CID 50985473
1-(3,5-dimethylpyrazol-1-yl)-3-[furan-2-ylmethyl(oxolan-3-ylmethyl)amino]propan-2-ol
CID 43818314
1-(1-ethylpiperidin-2-yl)-N-(furan-2-ylmethyl)methanamine
CID 115621753
N-(furan-2-ylmethyl)-N-(piperidin-4-ylmethyl)ethanamine
CID 61421310
2-[[(1-ethylpyrrolidin-2-yl)methyl-methylamino]methyl]aniline
CID 79303405
1-(1-cyclopentylpiperidin-4-yl)-N-(furan-2-ylmethyl)-N-(oxolan-2-ylmethyl)methanamine
CID 45219091
2-butyl-1-[(1-ethylpyrrolidin-2-yl)methyl]-3-[2-(furan-2-yl)ethyl]-1-methylguanidine
CID 110053986
3-(furan-2-ylmethyl)-1-methyl-1-(oxolan-3-ylmethyl)urea
CID 91905754
N,N-dimethyl-N'-[(5-methylfuran-2-yl)methyl]-N'-(oxolan-3-ylmethyl)ethane-1,2-diamine
CID 43818351
N-benzyl-1-[(2R)-1-ethylpyrrolidin-2-yl]-N-(pyridin-4-ylmethyl)methanamine
CID 51631520
(2R)-N-ethyl-2-(furan-2-yl)-N-[[(3S)-oxolan-3-yl]methyl]pyrrolidine-1-sulfonamide
CID 96510791

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylpyrrolidin-2-yl)methyl]-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)methanamine?
The IUPAC name of N-[(1-ethylpyrrolidin-2-yl)methyl]-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)methanamine (CID 43818363) is N-[(1-ethylpyrrolidin-2-yl)methyl]-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)methanamine.
What is the SMILES notation for N-[(1-ethylpyrrolidin-2-yl)methyl]-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)methanamine?
The canonical SMILES for N-[(1-ethylpyrrolidin-2-yl)methyl]-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)methanamine is CCN1CCCC1CN(Cc1ccco1)CC1CCOC1.
What is the InChIKey of N-[(1-ethylpyrrolidin-2-yl)methyl]-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)methanamine?
The InChIKey is RLOADQGYRKPQCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-2-19-8-3-5-16(19)12-18(11-15-7-10-20-14-15)13-17-6-4-9-21-17/h4,6,9,15-16H,2-3,5,7-8,10-14H2,1H3.
What are the key properties of N-[(1-ethylpyrrolidin-2-yl)methyl]-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)methanamine?
N-[(1-ethylpyrrolidin-2-yl)methyl]-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)methanamine has a molecular weight of 292.42 g/mol, XLogP of 2.60, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylpyrrolidin-2-yl)methyl]-N-(furan-2-ylmethyl)-1-(oxolan-3-yl)methanamine is sourced from PubChem (CID 43818363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).