2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide

C13H20N2O2 — CID 54869738

IUPAC2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide
SMILESCC(N)C(=O)N(C)Cc1ccc(C2CC2C)o1
InChIInChI=1S/C13H20N2O2/c1-8-6-11(8)12-5-4-10(17-12)7-15(3)13(16)9(2)14/h4-5,8-9,11H,6-7,14H2,1-3H3
InChIKeyCDXAPWWGUSJZHB-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.71
Rot. Bonds4

About 2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide

2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide (PubChem CID 54869738) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide
PubChem CID54869738
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide
SMILESCC(N)C(=O)N(C)Cc1ccc(C2CC2C)o1
InChIInChI=1S/C13H20N2O2/c1-8-6-11(8)12-5-4-10(17-12)7-15(3)13(16)9(2)14/h4-5,8-9,11H,6-7,14H2,1-3H3
InChIKeyCDXAPWWGUSJZHB-UHFFFAOYSA-N
XLogP1.71
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide
CID 60939227
2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide
CID 62473759
2-hydroxyethyl N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]carbamate
CID 79345361
5-hydroxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]pentanamide
CID 79191839
2-[methyl-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]sulfamoyl]propanoic acid
CID 61455218
(2S)-2-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 61146960
3,3,3-trifluoro-N-methyl-N-[[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]methyl]propanamide
CID 94001595
3,3,3-trifluoro-N-methyl-N-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]propanamide
CID 94001598
4-bromo-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]benzamide
CID 60697653
N,N-diethyl-2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]propanamide
CID 43739403
2-bromo-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]benzamide
CID 60697652
N,4-dimethyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]piperidine-4-carboxamide
CID 63122159

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide?
The IUPAC name of 2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide (CID 54869738) is 2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide.
What is the SMILES notation for 2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide?
The canonical SMILES for 2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide is CC(N)C(=O)N(C)Cc1ccc(C2CC2C)o1.
What is the InChIKey of 2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide?
The InChIKey is CDXAPWWGUSJZHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-8-6-11(8)12-5-4-10(17-12)7-15(3)13(16)9(2)14/h4-5,8-9,11H,6-7,14H2,1-3H3.
What are the key properties of 2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide?
2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide has a molecular weight of 236.31 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]propanamide is sourced from PubChem (CID 54869738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).