1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine

C12H19NO — CID 63988709

IUPAC1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine
SMILESCc1ccc(CNC(C)CC2CC2)o1
InChIInChI=1S/C12H19NO/c1-9(7-11-4-5-11)13-8-12-6-3-10(2)14-12/h3,6,9,11,13H,4-5,7-8H2,1-2H3
InChIKeyGNFPCCLAOAGCBB-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.87
Rot. Bonds5

About 1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine

1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine (PubChem CID 63988709) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine
PubChem CID63988709
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine
SMILESCc1ccc(CNC(C)CC2CC2)o1
InChIInChI=1S/C12H19NO/c1-9(7-11-4-5-11)13-8-12-6-3-10(2)14-12/h3,6,9,11,13H,4-5,7-8H2,1-2H3
InChIKeyGNFPCCLAOAGCBB-UHFFFAOYSA-N
XLogP2.87
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-cyclopentyl-N-[(5-methylfuran-2-yl)methyl]ethanamine
CID 81386114
1-cyclopropyl-N-[(3-methyl-1,2-oxazol-5-yl)methyl]propan-2-amine
CID 115717515
1-(1-ethylpiperidin-4-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine
CID 55081497
(2S)-N-[(5-methylfuran-2-yl)methyl]-1-phenylpropan-2-amine
CID 781905
4-[2-[(5-methylfuran-2-yl)methylamino]propyl]phenol
CID 78943399
(2S)-N-[(5-methylfuran-2-yl)methyl]-4-phenylbutan-2-amine
CID 40725603
2-[(1-cyclopropylpropan-2-ylamino)methyl]phenol
CID 63988689
1-N,1-N-diethyl-4-N-[(5-methylfuran-2-yl)methyl]pentane-1,4-diamine
CID 4825725
3-ethyl-N-[(5-methylfuran-2-yl)methyl]cyclopentan-1-amine
CID 64500285
1-N,1-N,4-trimethyl-2-N-[(5-methylfuran-2-yl)methyl]pentane-1,2-diamine
CID 43751641
(2R)-N-[(5-methylfuran-2-yl)methyl]-1-(4-methylpyrazol-1-yl)propan-2-amine
CID 95287009
N-[(3-chloro-4-methylphenyl)methyl]-1-cyclopropylpropan-2-amine
CID 106816843

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine?
The IUPAC name of 1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine (CID 63988709) is 1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine.
What is the SMILES notation for 1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine?
The canonical SMILES for 1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine is Cc1ccc(CNC(C)CC2CC2)o1.
What is the InChIKey of 1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine?
The InChIKey is GNFPCCLAOAGCBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-9(7-11-4-5-11)13-8-12-6-3-10(2)14-12/h3,6,9,11,13H,4-5,7-8H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine?
1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine has a molecular weight of 193.29 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(5-methylfuran-2-yl)methyl]propan-2-amine is sourced from PubChem (CID 63988709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).