1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea

C17H21N3O2 — CID 97048571

IUPAC1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea
SMILESC[C@H](c1ccco1)N(C(=O)NCCc1cccnc1)C1CC1
InChIInChI=1S/C17H21N3O2/c1-13(16-5-3-11-22-16)20(15-6-7-15)17(21)19-10-8-14-4-2-9-18-12-14/h2-5,9,11-13,15H,6-8,10H2,1H3,(H,19,21)/t13-/m1/s1
InChIKeyZRUCGFJDBYXFFN-CYBMUJFWSA-N
MW299.37 g/mol
LogP3.15
Rot. Bonds6

About 1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea

1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea (PubChem CID 97048571) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is 1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea.

Molecular Properties

Compound Name1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea
PubChem CID97048571
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC Name1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea
SMILESC[C@H](c1ccco1)N(C(=O)NCCc1cccnc1)C1CC1
InChIInChI=1S/C17H21N3O2/c1-13(16-5-3-11-22-16)20(15-6-7-15)17(21)19-10-8-14-4-2-9-18-12-14/h2-5,9,11-13,15H,6-8,10H2,1H3,(H,19,21)/t13-/m1/s1
InChIKeyZRUCGFJDBYXFFN-CYBMUJFWSA-N
XLogP3.15
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea with MolForge

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Related Compounds

1-cyclopropyl-1-[(1S)-1-(furan-2-yl)ethyl]-3-[(2R)-2-pyridin-4-ylpropyl]urea
CID 97222800
1-cyclopropyl-3-[[2-(dimethylamino)-3-pyridinyl]methyl]-1-[1-(furan-2-yl)ethyl]urea
CID 75425426
1,1-dimethyl-3-(2-pyridin-3-ylethyl)urea
CID 110872248
1-cyclopropyl-3-[(1-cyclopropyltetrazol-5-yl)methyl]-1-[1-(furan-2-yl)ethyl]urea
CID 75425430
N-propan-2-yl-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 61215927
N-(2-pyridin-3-ylethyl)-2,3-dihydro-1-benzofuran-2-carboxamide
CID 47153707
1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(1H-indol-2-ylmethyl)urea
CID 97048634
2-[carboxymethyl(2-pyridin-3-ylethylcarbamoyl)amino]acetic acid
CID 63645112
2-cyclopentyl-N-cyclopropyl-N-[1-(furan-2-yl)ethyl]acetamide
CID 60576605
3-[(1R)-cyclohex-3-en-1-yl]-1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]urea
CID 97048743
2-amino-4-methyl-N-(2-pyridin-3-ylethyl)pentanamide
CID 60913916
2-amino-N-(2-pyridin-3-ylethyl)cyclohexane-1-carboxamide
CID 64822976

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea?
The IUPAC name of 1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea (CID 97048571) is 1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea.
What is the SMILES notation for 1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea?
The canonical SMILES for 1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea is C[C@H](c1ccco1)N(C(=O)NCCc1cccnc1)C1CC1.
What is the InChIKey of 1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea?
The InChIKey is ZRUCGFJDBYXFFN-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H21N3O2/c1-13(16-5-3-11-22-16)20(15-6-7-15)17(21)19-10-8-14-4-2-9-18-12-14/h2-5,9,11-13,15H,6-8,10H2,1H3,(H,19,21)/t13-/m1/s1.
What are the key properties of 1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea?
1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea has a molecular weight of 299.37 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-[(1R)-1-(furan-2-yl)ethyl]-3-(2-pyridin-3-ylethyl)urea is sourced from PubChem (CID 97048571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).