N-[(1-cyclopropylcyclopropyl)methyl]-1-(furan-2-yl)ethanamine

C13H19NO — CID 115895715

IUPACN-[(1-cyclopropylcyclopropyl)methyl]-1-(furan-2-yl)ethanamine
SMILESCC(NCC1(C2CC2)CC1)c1ccco1
InChIInChI=1S/C13H19NO/c1-10(12-3-2-8-15-12)14-9-13(6-7-13)11-4-5-11/h2-3,8,10-11,14H,4-7,9H2,1H3
InChIKeyHFUBLCXGDSYMOT-UHFFFAOYSA-N
MW205.30 g/mol
LogP3.12
Rot. Bonds5

About N-[(1-cyclopropylcyclopropyl)methyl]-1-(furan-2-yl)ethanamine

N-[(1-cyclopropylcyclopropyl)methyl]-1-(furan-2-yl)ethanamine (PubChem CID 115895715) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is N-[(1-cyclopropylcyclopropyl)methyl]-1-(furan-2-yl)ethanamine.

Molecular Properties

Compound NameN-[(1-cyclopropylcyclopropyl)methyl]-1-(furan-2-yl)ethanamine
PubChem CID115895715
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC NameN-[(1-cyclopropylcyclopropyl)methyl]-1-(furan-2-yl)ethanamine
SMILESCC(NCC1(C2CC2)CC1)c1ccco1
InChIInChI=1S/C13H19NO/c1-10(12-3-2-8-15-12)14-9-13(6-7-13)11-4-5-11/h2-3,8,10-11,14H,4-7,9H2,1H3
InChIKeyHFUBLCXGDSYMOT-UHFFFAOYSA-N
XLogP3.12
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(furan-2-yl)-N-[(1-propylcyclobutyl)methyl]ethanamine
CID 115893829
1-[[1-(furan-2-yl)ethylamino]methyl]-N,N-dimethylcyclohexan-1-amine
CID 43201850
4-[[1-(furan-2-yl)ethylamino]methyl]thian-4-ol
CID 115722103
(1S)-N-[(4-cyclopropylphenyl)methyl]-1-(furan-2-yl)ethanamine
CID 81403532
N-(2-cyclopentylethyl)-1-(furan-2-yl)ethanamine
CID 60919683
N-[(1-cyclopropylcyclopropyl)methyl]-1-(2-nitrophenyl)ethanamine
CID 103841179
N-[(1-cyclopropylcyclopropyl)methyl]-1-(2,4-dichlorophenyl)ethanamine
CID 114095465
N-(2-cyclohexylethyl)-1-(furan-2-yl)ethanamine
CID 60919809
1-(furan-2-yl)-N'-[1-(furan-2-yl)ethyl]-N,N-dimethylethane-1,2-diamine
CID 43202373
(1S)-1-(furan-2-yl)-N-[(1-methylpiperidin-2-yl)methyl]ethanamine
CID 81403117
(1S)-1-(furan-2-yl)-N-[(5-methyloxolan-2-yl)methyl]ethanamine
CID 82836690
(1R)-1-(furan-2-yl)-N-[(1-methylpiperidin-4-yl)methyl]ethanamine
CID 81403301

Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopropylcyclopropyl)methyl]-1-(furan-2-yl)ethanamine?
The IUPAC name of N-[(1-cyclopropylcyclopropyl)methyl]-1-(furan-2-yl)ethanamine (CID 115895715) is N-[(1-cyclopropylcyclopropyl)methyl]-1-(furan-2-yl)ethanamine.
What is the SMILES notation for N-[(1-cyclopropylcyclopropyl)methyl]-1-(furan-2-yl)ethanamine?
The canonical SMILES for N-[(1-cyclopropylcyclopropyl)methyl]-1-(furan-2-yl)ethanamine is CC(NCC1(C2CC2)CC1)c1ccco1.
What is the InChIKey of N-[(1-cyclopropylcyclopropyl)methyl]-1-(furan-2-yl)ethanamine?
The InChIKey is HFUBLCXGDSYMOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10(12-3-2-8-15-12)14-9-13(6-7-13)11-4-5-11/h2-3,8,10-11,14H,4-7,9H2,1H3.
What are the key properties of N-[(1-cyclopropylcyclopropyl)methyl]-1-(furan-2-yl)ethanamine?
N-[(1-cyclopropylcyclopropyl)methyl]-1-(furan-2-yl)ethanamine has a molecular weight of 205.30 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopropylcyclopropyl)methyl]-1-(furan-2-yl)ethanamine is sourced from PubChem (CID 115895715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).