1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea

C13H15N3O2 — CID 47172008

IUPAC1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea
SMILESCC(Cc1ccco1)NC(=O)Nc1cccnc1
InChIInChI=1S/C13H15N3O2/c1-10(8-12-5-3-7-18-12)15-13(17)16-11-4-2-6-14-9-11/h2-7,9-10H,8H2,1H3,(H2,15,16,17)
InChIKeyKUWVSACWAMUYNT-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.43
Rot. Bonds4

About 1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea

1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea (PubChem CID 47172008) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea.

Molecular Properties

Compound Name1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea
PubChem CID47172008
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea
SMILESCC(Cc1ccco1)NC(=O)Nc1cccnc1
InChIInChI=1S/C13H15N3O2/c1-10(8-12-5-3-7-18-12)15-13(17)16-11-4-2-6-14-9-11/h2-7,9-10H,8H2,1H3,(H2,15,16,17)
InChIKeyKUWVSACWAMUYNT-UHFFFAOYSA-N
XLogP2.43
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-(furan-2-yl)propan-2-yl]-3-(3-methoxyphenyl)urea
CID 47172007
1-(4-chlorophenyl)-3-[1-(furan-2-yl)propan-2-yl]urea
CID 47171952
1-(1-methoxypropan-2-yl)-3-pyridin-3-ylurea
CID 51264614
N-[3-[1-(furan-2-yl)propan-2-ylcarbamoylamino]phenyl]thiophene-2-carboxamide
CID 55698314
1-[(2S)-1-(furan-2-yl)propan-2-yl]-3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]urea
CID 92868257
N-[1-(furan-2-yl)propan-2-yl]-4-hydrazinylpyridine-3-carboxamide
CID 81256734
2-anilino-N-[1-(furan-2-yl)propan-2-yl]acetamide
CID 60861599
1-[3-(furan-2-ylmethoxy)propyl]-3-pyridin-3-ylurea
CID 47126067
4-methyl-2-(pyridin-3-ylcarbamoylamino)pentanoic acid
CID 61187819
N-[1-(furan-2-yl)propan-2-yl]pyridine-2-carboxamide
CID 42957156
4-[1-(furan-2-yl)propan-2-ylcarbamoylamino]-3-methylbutanoic acid
CID 81070013
2-ethyl-2-[1-(furan-2-yl)propan-2-ylcarbamoylamino]butanoic acid
CID 79803984

Frequently Asked Questions

What is the IUPAC name of 1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea?
The IUPAC name of 1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea (CID 47172008) is 1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea.
What is the SMILES notation for 1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea?
The canonical SMILES for 1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea is CC(Cc1ccco1)NC(=O)Nc1cccnc1.
What is the InChIKey of 1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea?
The InChIKey is KUWVSACWAMUYNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-10(8-12-5-3-7-18-12)15-13(17)16-11-4-2-6-14-9-11/h2-7,9-10H,8H2,1H3,(H2,15,16,17).
What are the key properties of 1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea?
1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea has a molecular weight of 245.28 g/mol, XLogP of 2.43, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(furan-2-yl)propan-2-yl]-3-pyridin-3-ylurea is sourced from PubChem (CID 47172008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).