2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide

C10H16N2O2 — CID 61371044

IUPAC2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide
SMILESCc1occc1CN(C)C(C)C(N)=O
InChIInChI=1S/C10H16N2O2/c1-7(10(11)13)12(3)6-9-4-5-14-8(9)2/h4-5,7H,6H2,1-3H3,(H2,11,13)
InChIKeyVYXILRBYEKNETM-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.89
Rot. Bonds4

About 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide

2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide (PubChem CID 61371044) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide.

Molecular Properties

Compound Name2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide
PubChem CID61371044
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide
SMILESCc1occc1CN(C)C(C)C(N)=O
InChIInChI=1S/C10H16N2O2/c1-7(10(11)13)12(3)6-9-4-5-14-8(9)2/h4-5,7H,6H2,1-3H3,(H2,11,13)
InChIKeyVYXILRBYEKNETM-UHFFFAOYSA-N
XLogP0.89
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-3-[methyl-[(2-methylfuran-3-yl)methyl]amino]butanamide
CID 66426470
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]acetamide
CID 61370638
1-(2,5-dimethylphenyl)-2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propan-1-one
CID 62035271
N-(2-aminophenyl)-2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide
CID 61426661
2-amino-N-methyl-N-[(2-methylfuran-3-yl)methyl]propanamide
CID 61426214
2-bromo-N,3-dimethyl-N-[(2-methylfuran-3-yl)methyl]butanamide
CID 61426211
N-methyl-N-[(2-methylfuran-3-yl)methyl]hydroxylamine
CID 96732982
1-methyl-1-[(2-methylfuran-3-yl)methyl]-2-(2-methylpropyl)guanidine
CID 62378928
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]-2-phenylacetic acid
CID 61426935
(2S)-2-[(2-chlorophenyl)methyl-methylamino]propanamide
CID 8541703
3-chloro-N,2-dimethyl-N-[(2-methylfuran-3-yl)methyl]propanamide
CID 62729105
4-amino-3-[methyl-[(2-methylfuran-3-yl)methyl]amino]-1-pyrrolidin-1-ylbutan-1-one
CID 66432322

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide?
The IUPAC name of 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide (CID 61371044) is 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide.
What is the SMILES notation for 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide?
The canonical SMILES for 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide is Cc1occc1CN(C)C(C)C(N)=O.
What is the InChIKey of 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide?
The InChIKey is VYXILRBYEKNETM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-7(10(11)13)12(3)6-9-4-5-14-8(9)2/h4-5,7H,6H2,1-3H3,(H2,11,13).
What are the key properties of 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide?
2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide has a molecular weight of 196.25 g/mol, XLogP of 0.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[(2-methylfuran-3-yl)methyl]amino]propanamide is sourced from PubChem (CID 61371044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).