N-cyclopropyl-N-(furan-2-ylmethyl)-4-(methylaminomethyl)-1,3-oxazol-2-amine

C13H17N3O2 — CID 113377759

IUPACN-cyclopropyl-N-(furan-2-ylmethyl)-4-(methylaminomethyl)-1,3-oxazol-2-amine
SMILESCNCc1coc(N(Cc2ccco2)C2CC2)n1
InChIInChI=1S/C13H17N3O2/c1-14-7-10-9-18-13(15-10)16(11-4-5-11)8-12-3-2-6-17-12/h2-3,6,9,11,14H,4-5,7-8H2,1H3
InChIKeySYZMVHPSLISCDG-UHFFFAOYSA-N
MW247.30 g/mol
LogP2.16
Rot. Bonds6

About N-cyclopropyl-N-(furan-2-ylmethyl)-4-(methylaminomethyl)-1,3-oxazol-2-amine

N-cyclopropyl-N-(furan-2-ylmethyl)-4-(methylaminomethyl)-1,3-oxazol-2-amine (PubChem CID 113377759) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is N-cyclopropyl-N-(furan-2-ylmethyl)-4-(methylaminomethyl)-1,3-oxazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-(furan-2-ylmethyl)-4-(methylaminomethyl)-1,3-oxazol-2-amine
PubChem CID113377759
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC NameN-cyclopropyl-N-(furan-2-ylmethyl)-4-(methylaminomethyl)-1,3-oxazol-2-amine
SMILESCNCc1coc(N(Cc2ccco2)C2CC2)n1
InChIInChI=1S/C13H17N3O2/c1-14-7-10-9-18-13(15-10)16(11-4-5-11)8-12-3-2-6-17-12/h2-3,6,9,11,14H,4-5,7-8H2,1H3
InChIKeySYZMVHPSLISCDG-UHFFFAOYSA-N
XLogP2.16
TPSA54.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-N-cyclopropyl-6-N-(furan-2-ylmethyl)pyridine-2,3,6-triamine
CID 79827765
2-N-cyclopropyl-2-N-(furan-2-ylmethyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine
CID 80814460
3-(aminomethyl)-N-cyclopropyl-N-(furan-2-ylmethyl)-2,6-dimethylpyridin-4-amine
CID 81050858
2-chloro-N-cyclopropyl-N-(furan-2-ylmethyl)pyrimidin-4-amine
CID 62343468
4-N-cyclopropyl-4-N-(furan-2-ylmethyl)-2-methylbenzene-1,4-diamine
CID 55003816
6-(chloromethyl)-N-cyclopropyl-N-(furan-2-ylmethyl)pyrazin-2-amine
CID 66466642
4-N-cyclopropyl-4-N-(furan-2-ylmethyl)-6-N-methyl-5-propylpyrimidine-4,6-diamine
CID 80789459
5-bromo-N-cyclopropyl-N-(furan-2-ylmethyl)-4-methylpyridin-2-amine
CID 115773896
N-(furan-2-ylmethyl)-N-[[3-(methylaminomethyl)-1,2-oxazol-5-yl]methyl]ethanamine
CID 62462824
5-N-cyclopropyl-3-N-ethyl-5-N-(furan-2-ylmethyl)pyridine-3,5-diamine
CID 104533818
2-N-cyclopropyl-2-N-(furan-2-ylmethyl)-5-methylpyridine-2,3-diamine
CID 66281069
5-bromo-N-cyclopropyl-N-(furan-2-ylmethyl)-1,3,4-thiadiazol-2-amine
CID 64622852

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(furan-2-ylmethyl)-4-(methylaminomethyl)-1,3-oxazol-2-amine?
The IUPAC name of N-cyclopropyl-N-(furan-2-ylmethyl)-4-(methylaminomethyl)-1,3-oxazol-2-amine (CID 113377759) is N-cyclopropyl-N-(furan-2-ylmethyl)-4-(methylaminomethyl)-1,3-oxazol-2-amine.
What is the SMILES notation for N-cyclopropyl-N-(furan-2-ylmethyl)-4-(methylaminomethyl)-1,3-oxazol-2-amine?
The canonical SMILES for N-cyclopropyl-N-(furan-2-ylmethyl)-4-(methylaminomethyl)-1,3-oxazol-2-amine is CNCc1coc(N(Cc2ccco2)C2CC2)n1.
What is the InChIKey of N-cyclopropyl-N-(furan-2-ylmethyl)-4-(methylaminomethyl)-1,3-oxazol-2-amine?
The InChIKey is SYZMVHPSLISCDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-14-7-10-9-18-13(15-10)16(11-4-5-11)8-12-3-2-6-17-12/h2-3,6,9,11,14H,4-5,7-8H2,1H3.
What are the key properties of N-cyclopropyl-N-(furan-2-ylmethyl)-4-(methylaminomethyl)-1,3-oxazol-2-amine?
N-cyclopropyl-N-(furan-2-ylmethyl)-4-(methylaminomethyl)-1,3-oxazol-2-amine has a molecular weight of 247.30 g/mol, XLogP of 2.16, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(furan-2-ylmethyl)-4-(methylaminomethyl)-1,3-oxazol-2-amine is sourced from PubChem (CID 113377759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).