1-(1-piperidin-3-ylethyl)-3-propylurea

C11H23N3O — CID 43523385

IUPAC1-(1-piperidin-3-ylethyl)-3-propylurea
SMILESCCCNC(=O)NC(C)C1CCCNC1
InChIInChI=1S/C11H23N3O/c1-3-6-13-11(15)14-9(2)10-5-4-7-12-8-10/h9-10,12H,3-8H2,1-2H3,(H2,13,14,15)
InChIKeyGADXNBRBCSROBM-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.08
Rot. Bonds4

About 1-(1-piperidin-3-ylethyl)-3-propylurea

1-(1-piperidin-3-ylethyl)-3-propylurea (PubChem CID 43523385) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 1-(1-piperidin-3-ylethyl)-3-propylurea.

Molecular Properties

Compound Name1-(1-piperidin-3-ylethyl)-3-propylurea
PubChem CID43523385
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name1-(1-piperidin-3-ylethyl)-3-propylurea
SMILESCCCNC(=O)NC(C)C1CCCNC1
InChIInChI=1S/C11H23N3O/c1-3-6-13-11(15)14-9(2)10-5-4-7-12-8-10/h9-10,12H,3-8H2,1-2H3,(H2,13,14,15)
InChIKeyGADXNBRBCSROBM-UHFFFAOYSA-N
XLogP1.08
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-butyl-3-(1-piperidin-3-ylethyl)urea
CID 43523386
1-(1-piperidin-3-ylethyl)-3-propan-2-ylurea
CID 43523388
1-tert-butyl-3-[(1S)-1-[(3S)-piperidin-3-yl]ethyl]urea
CID 93096345
1-benzyl-3-(1-piperidin-3-ylethyl)urea
CID 107653393
N-(1-piperidin-3-ylethyl)cyclopentanecarboxamide
CID 43523140
N-[2-oxo-2-(propylamino)ethyl]-3-piperidin-3-ylbutanamide
CID 81044804
(2R)-2-amino-N-(1-piperidin-3-ylethyl)propanamide
CID 131038230
2-amino-N-(1-piperidin-3-ylethyl)propanamide
CID 131134166
2-cyclobutyl-N-(1-piperidin-3-ylethyl)acetamide
CID 103806063
2-cycloheptyl-N-(1-piperidin-3-ylethyl)acetamide
CID 115736930
3,4,4-trimethyl-N-(1-piperidin-3-ylethyl)pentanamide
CID 63834825
N-(1-piperidin-3-ylethyl)piperidine-1-carboxamide
CID 79155447

Frequently Asked Questions

What is the IUPAC name of 1-(1-piperidin-3-ylethyl)-3-propylurea?
The IUPAC name of 1-(1-piperidin-3-ylethyl)-3-propylurea (CID 43523385) is 1-(1-piperidin-3-ylethyl)-3-propylurea.
What is the SMILES notation for 1-(1-piperidin-3-ylethyl)-3-propylurea?
The canonical SMILES for 1-(1-piperidin-3-ylethyl)-3-propylurea is CCCNC(=O)NC(C)C1CCCNC1.
What is the InChIKey of 1-(1-piperidin-3-ylethyl)-3-propylurea?
The InChIKey is GADXNBRBCSROBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-3-6-13-11(15)14-9(2)10-5-4-7-12-8-10/h9-10,12H,3-8H2,1-2H3,(H2,13,14,15).
What are the key properties of 1-(1-piperidin-3-ylethyl)-3-propylurea?
1-(1-piperidin-3-ylethyl)-3-propylurea has a molecular weight of 213.32 g/mol, XLogP of 1.08, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-piperidin-3-ylethyl)-3-propylurea is sourced from PubChem (CID 43523385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).