1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea

C19H33N3O2 — CID 97221526

IUPAC1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea
SMILESO=C(NC[C@H]1CCN(C2CC2)C1)N(C[C@H]1CCCO1)C1CCCC1
InChIInChI=1S/C19H33N3O2/c23-19(20-12-15-9-10-21(13-15)16-7-8-16)22(17-4-1-2-5-17)14-18-6-3-11-24-18/h15-18H,1-14H2,(H,20,23)/t15-,18-/m1/s1
InChIKeySVVKMIHTMBNEDM-CRAIPNDOSA-N
MW335.49 g/mol
LogP2.60
Rot. Bonds6

About 1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea

1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea (PubChem CID 97221526) has the molecular formula C19H33N3O2 and a molecular weight of 335.49 g/mol. Its IUPAC name is 1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea.

Molecular Properties

Compound Name1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea
PubChem CID97221526
Molecular FormulaC19H33N3O2
Molecular Weight335.49 g/mol
Exact Mass335.26
IUPAC Name1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea
SMILESO=C(NC[C@H]1CCN(C2CC2)C1)N(C[C@H]1CCCO1)C1CCCC1
InChIInChI=1S/C19H33N3O2/c23-19(20-12-15-9-10-21(13-15)16-7-8-16)22(17-4-1-2-5-17)14-18-6-3-11-24-18/h15-18H,1-14H2,(H,20,23)/t15-,18-/m1/s1
InChIKeySVVKMIHTMBNEDM-CRAIPNDOSA-N
XLogP2.60
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.49
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea with MolForge

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Related Compounds

1-cyclopentyl-3-(1-cyclopropylpiperidin-4-yl)-1-[[(2S)-oxolan-2-yl]methyl]urea
CID 97080243
1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-(furan-2-ylmethyl)urea
CID 97078813
1-(1-methylpiperidin-4-yl)-1-[[(2R)-oxolan-2-yl]methyl]-3-propylurea
CID 40641442
2-chloro-N-[(1-cyclopropylpyrrolidin-3-yl)methyl]acetamide
CID 60809819
1-cyclopentyl-3-[2-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)ethyl]-1-[[(2R)-oxolan-2-yl]methyl]urea
CID 97048924
[1-(oxan-4-yl)pyrrolidin-3-yl]methylcarbamic acid
CID 67502447
3-[(1-cyclopropylpyrrolidin-3-yl)methylamino]-3-oxopropanoic acid
CID 62231885
1-cyclopentyl-3-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-(oxolan-2-ylmethyl)urea
CID 71861206
1-cyclopentyl-3-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]-1-[[(2R)-oxolan-2-yl]methyl]urea
CID 97010472
N-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-oxobutanamide
CID 60975912
1-(cyclohexylmethyl)-1-cyclopropyl-3-[[4-(2-methylpropyl)morpholin-2-yl]methyl]urea
CID 55912395
N-[[(3S)-1-cyclopentylpyrrolidin-3-yl]methyl]-N',N'-diethyloxamide
CID 95216515

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea?
The IUPAC name of 1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea (CID 97221526) is 1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea.
What is the SMILES notation for 1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea?
The canonical SMILES for 1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea is O=C(NC[C@H]1CCN(C2CC2)C1)N(C[C@H]1CCCO1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea?
The InChIKey is SVVKMIHTMBNEDM-CRAIPNDOSA-N. The full InChI is InChI=1S/C19H33N3O2/c23-19(20-12-15-9-10-21(13-15)16-7-8-16)22(17-4-1-2-5-17)14-18-6-3-11-24-18/h15-18H,1-14H2,(H,20,23)/t15-,18-/m1/s1.
What are the key properties of 1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea?
1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea has a molecular weight of 335.49 g/mol, XLogP of 2.60, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-[[(3R)-1-cyclopropylpyrrolidin-3-yl]methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea is sourced from PubChem (CID 97221526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).