N-ethyl-1-(3-methylfuran-2-yl)propan-1-amine

C10H17NO — CID 104805164

IUPACN-ethyl-1-(3-methylfuran-2-yl)propan-1-amine
SMILESCCNC(CC)c1occc1C
InChIInChI=1S/C10H17NO/c1-4-9(11-5-2)10-8(3)6-7-12-10/h6-7,9,11H,4-5H2,1-3H3
InChIKeyBAXCPCZUGDQFCX-UHFFFAOYSA-N
MW167.25 g/mol
LogP2.65
Rot. Bonds4

About N-ethyl-1-(3-methylfuran-2-yl)propan-1-amine

N-ethyl-1-(3-methylfuran-2-yl)propan-1-amine (PubChem CID 104805164) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is N-ethyl-1-(3-methylfuran-2-yl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(3-methylfuran-2-yl)propan-1-amine
PubChem CID104805164
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC NameN-ethyl-1-(3-methylfuran-2-yl)propan-1-amine
SMILESCCNC(CC)c1occc1C
InChIInChI=1S/C10H17NO/c1-4-9(11-5-2)10-8(3)6-7-12-10/h6-7,9,11H,4-5H2,1-3H3
InChIKeyBAXCPCZUGDQFCX-UHFFFAOYSA-N
XLogP2.65
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-methylfuran-2-yl)-N-propylpropan-1-amine
CID 104805698
N-ethyl-1-(3-methylfuran-2-yl)octan-1-amine
CID 104805256
N-ethyl-5-methyl-1-(3-methylfuran-2-yl)hexan-1-amine
CID 104805236
N-ethyl-1-(3-methylfuran-2-yl)decan-1-amine
CID 104805306
N-ethyl-1-(3-methylfuran-2-yl)-2-(2-methylphenyl)ethanamine
CID 61063846
N-ethyl-2-(furan-3-yl)-1-(3-methylfuran-2-yl)ethanamine
CID 104805287
3-cyclopropyl-N-ethyl-1-(3-methylfuran-2-yl)propan-1-amine
CID 104805642
N-ethyl-1-(3-methylfuran-2-yl)prop-2-yn-1-amine
CID 104805469
2-(2,5-difluorophenyl)-N-ethyl-1-(3-methylfuran-2-yl)ethanamine
CID 104805432
N-ethyl-1-(3-methylfuran-2-yl)-2-naphthalen-2-ylethanamine
CID 61077634
3-ethyl-N-methyl-1-(3-methylfuran-2-yl)pentan-1-amine
CID 104805125
2-butan-2-yl-3-methylfuran
CID 89080868

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(3-methylfuran-2-yl)propan-1-amine?
The IUPAC name of N-ethyl-1-(3-methylfuran-2-yl)propan-1-amine (CID 104805164) is N-ethyl-1-(3-methylfuran-2-yl)propan-1-amine.
What is the SMILES notation for N-ethyl-1-(3-methylfuran-2-yl)propan-1-amine?
The canonical SMILES for N-ethyl-1-(3-methylfuran-2-yl)propan-1-amine is CCNC(CC)c1occc1C.
What is the InChIKey of N-ethyl-1-(3-methylfuran-2-yl)propan-1-amine?
The InChIKey is BAXCPCZUGDQFCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-4-9(11-5-2)10-8(3)6-7-12-10/h6-7,9,11H,4-5H2,1-3H3.
What are the key properties of N-ethyl-1-(3-methylfuran-2-yl)propan-1-amine?
N-ethyl-1-(3-methylfuran-2-yl)propan-1-amine has a molecular weight of 167.25 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(3-methylfuran-2-yl)propan-1-amine is sourced from PubChem (CID 104805164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).