N-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide

C14H20N4O2 — CID 61462816

IUPACN-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide
SMILESCC(Cn1cccn1)NC(C)C(=O)NCc1ccco1
InChIInChI=1S/C14H20N4O2/c1-11(10-18-7-4-6-16-18)17-12(2)14(19)15-9-13-5-3-8-20-13/h3-8,11-12,17H,9-10H2,1-2H3,(H,15,19)
InChIKeyVLRUBOGGWMCJAN-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.16
Rot. Bonds7

About N-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide

N-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide (PubChem CID 61462816) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide
PubChem CID61462816
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC NameN-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide
SMILESCC(Cn1cccn1)NC(C)C(=O)NCc1ccco1
InChIInChI=1S/C14H20N4O2/c1-11(10-18-7-4-6-16-18)17-12(2)14(19)15-9-13-5-3-8-20-13/h3-8,11-12,17H,9-10H2,1-2H3,(H,15,19)
InChIKeyVLRUBOGGWMCJAN-UHFFFAOYSA-N
XLogP1.16
TPSA72.09 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 60677219
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CID 82938141
(2R)-N-(furan-2-ylmethyl)-2-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]propanamide
CID 95611636
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CID 81401992
N-(furan-2-ylmethyl)-2-(1-pyridin-2-ylethylamino)propanamide
CID 43396718
N-(furan-2-ylmethyl)-2-(1-methylsulfanylbutan-2-ylamino)propanamide
CID 113494652
2-[[1-(furan-2-ylmethylamino)-1-oxopropan-2-yl]amino]acetic acid
CID 43466208
N-(furan-2-ylmethyl)-2-[(1-hydroxy-4-methylpentan-3-yl)amino]propanamide
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(2S)-N-[[(2R)-oxolan-2-yl]methyl]-2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]propanamide
CID 124852947
(2S)-N-(furan-2-ylmethyl)-3-methyl-2-pyrrol-1-ylbutanamide
CID 42426854

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide (CID 61462816) is N-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide is CC(Cn1cccn1)NC(C)C(=O)NCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide?
The InChIKey is VLRUBOGGWMCJAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-11(10-18-7-4-6-16-18)17-12(2)14(19)15-9-13-5-3-8-20-13/h3-8,11-12,17H,9-10H2,1-2H3,(H,15,19).
What are the key properties of N-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide?
N-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide has a molecular weight of 276.34 g/mol, XLogP of 1.16, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-(1-pyrazol-1-ylpropan-2-ylamino)propanamide is sourced from PubChem (CID 61462816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).