2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol

C17H30N2O2 — CID 81399970

IUPAC2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol
SMILESCCC(CC)(CO)CNCC(c1ccco1)N1CCCC1
InChIInChI=1S/C17H30N2O2/c1-3-17(4-2,14-20)13-18-12-15(16-8-7-11-21-16)19-9-5-6-10-19/h7-8,11,15,18,20H,3-6,9-10,12-14H2,1-2H3
InChIKeyDZWSYEBIYYNOMB-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.80
Rot. Bonds9

About 2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol

2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol (PubChem CID 81399970) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is 2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol.

Molecular Properties

Compound Name2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol
PubChem CID81399970
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC Name2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol
SMILESCCC(CC)(CO)CNCC(c1ccco1)N1CCCC1
InChIInChI=1S/C17H30N2O2/c1-3-17(4-2,14-20)13-18-12-15(16-8-7-11-21-16)19-9-5-6-10-19/h7-8,11,15,18,20H,3-6,9-10,12-14H2,1-2H3
InChIKeyDZWSYEBIYYNOMB-UHFFFAOYSA-N
XLogP2.80
TPSA48.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol with MolForge

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Related Compounds

2-(azepan-1-yl)-N-ethyl-2-(furan-2-yl)ethanamine
CID 22692497
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine
CID 83380875
N-(cyclopropylmethyl)-2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine
CID 43654889
(1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol
CID 2106497
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pentan-2-amine
CID 43202553
(2S)-2-amino-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pentanamide
CID 107569214
4-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]phenol
CID 43181226
2-(furan-2-yl)-N-[(4-methylphenyl)methyl]-2-pyrrolidin-1-ylethanamine
CID 43181232
2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]propanoic acid
CID 66174492
(2S)-2-amino-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]butanamide
CID 79023553
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]butanamide
CID 60636600
N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]butanamide
CID 93157841

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol?
The IUPAC name of 2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol (CID 81399970) is 2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol.
What is the SMILES notation for 2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol?
The canonical SMILES for 2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol is CCC(CC)(CO)CNCC(c1ccco1)N1CCCC1.
What is the InChIKey of 2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol?
The InChIKey is DZWSYEBIYYNOMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-3-17(4-2,14-20)13-18-12-15(16-8-7-11-21-16)19-9-5-6-10-19/h7-8,11,15,18,20H,3-6,9-10,12-14H2,1-2H3.
What are the key properties of 2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol?
2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol has a molecular weight of 294.44 g/mol, XLogP of 2.80, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-[[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]methyl]butan-1-ol is sourced from PubChem (CID 81399970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).