1-[3-(cyclopropylmethoxy)propyl]-3-[2-(morpholine-4-carbonyl)phenyl]urea

C19H27N3O4 — CID 55698561

IUPAC1-[3-(cyclopropylmethoxy)propyl]-3-[2-(morpholine-4-carbonyl)phenyl]urea
SMILESO=C(NCCCOCC1CC1)Nc1ccccc1C(=O)N1CCOCC1
InChIInChI=1S/C19H27N3O4/c23-18(22-9-12-25-13-10-22)16-4-1-2-5-17(16)21-19(24)20-8-3-11-26-14-15-6-7-15/h1-2,4-5,15H,3,6-14H2,(H2,20,21,24)
InChIKeyMKXMCMBOFSUDRC-UHFFFAOYSA-N
MW361.44 g/mol
LogP2.10
Rot. Bonds8

About 1-[3-(cyclopropylmethoxy)propyl]-3-[2-(morpholine-4-carbonyl)phenyl]urea

1-[3-(cyclopropylmethoxy)propyl]-3-[2-(morpholine-4-carbonyl)phenyl]urea (PubChem CID 55698561) has the molecular formula C19H27N3O4 and a molecular weight of 361.44 g/mol. Its IUPAC name is 1-[3-(cyclopropylmethoxy)propyl]-3-[2-(morpholine-4-carbonyl)phenyl]urea.

Molecular Properties

Compound Name1-[3-(cyclopropylmethoxy)propyl]-3-[2-(morpholine-4-carbonyl)phenyl]urea
PubChem CID55698561
Molecular FormulaC19H27N3O4
Molecular Weight361.44 g/mol
Exact Mass361.20
IUPAC Name1-[3-(cyclopropylmethoxy)propyl]-3-[2-(morpholine-4-carbonyl)phenyl]urea
SMILESO=C(NCCCOCC1CC1)Nc1ccccc1C(=O)N1CCOCC1
InChIInChI=1S/C19H27N3O4/c23-18(22-9-12-25-13-10-22)16-4-1-2-5-17(16)21-19(24)20-8-3-11-26-14-15-6-7-15/h1-2,4-5,15H,3,6-14H2,(H2,20,21,24)
InChIKeyMKXMCMBOFSUDRC-UHFFFAOYSA-N
XLogP2.10
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.44
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N,N'-bis[2-(morpholine-4-carbonyl)phenyl]decanediamide
CID 17080133
methyl N-[2-(morpholine-4-carbonyl)phenyl]carbamate
CID 740590
1-[3-(cyclopropylmethoxy)propyl]-3-(2,6-dimethylphenyl)urea
CID 47133545
1-propyl-3-[2-(pyrrolidine-1-carbonyl)phenyl]urea
CID 47201043
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
CID 119703964
2-(2-fluorophenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
CID 35325829
2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide
CID 25471927
7-amino-N-[2-(morpholine-4-carbonyl)phenyl]heptanamide
CID 119703947
1-(2-fluorophenyl)-3-[3-[[(2S)-oxolan-2-yl]methoxy]propyl]urea
CID 40881806
1-[2-[(2R)-2-cyanopropyl]sulfanylphenyl]-3-[3-(cyclopropylmethoxy)propyl]urea
CID 95330552
4-bromo-N-[3-[2-(morpholine-4-carbonyl)anilino]-3-oxopropyl]benzamide
CID 35326995
1-(3-imidazol-1-ylpropyl)-3-[2-methyl-3-(morpholine-4-carbonyl)phenyl]urea
CID 60569650

Frequently Asked Questions

What is the IUPAC name of 1-[3-(cyclopropylmethoxy)propyl]-3-[2-(morpholine-4-carbonyl)phenyl]urea?
The IUPAC name of 1-[3-(cyclopropylmethoxy)propyl]-3-[2-(morpholine-4-carbonyl)phenyl]urea (CID 55698561) is 1-[3-(cyclopropylmethoxy)propyl]-3-[2-(morpholine-4-carbonyl)phenyl]urea.
What is the SMILES notation for 1-[3-(cyclopropylmethoxy)propyl]-3-[2-(morpholine-4-carbonyl)phenyl]urea?
The canonical SMILES for 1-[3-(cyclopropylmethoxy)propyl]-3-[2-(morpholine-4-carbonyl)phenyl]urea is O=C(NCCCOCC1CC1)Nc1ccccc1C(=O)N1CCOCC1.
What is the InChIKey of 1-[3-(cyclopropylmethoxy)propyl]-3-[2-(morpholine-4-carbonyl)phenyl]urea?
The InChIKey is MKXMCMBOFSUDRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O4/c23-18(22-9-12-25-13-10-22)16-4-1-2-5-17(16)21-19(24)20-8-3-11-26-14-15-6-7-15/h1-2,4-5,15H,3,6-14H2,(H2,20,21,24).
What are the key properties of 1-[3-(cyclopropylmethoxy)propyl]-3-[2-(morpholine-4-carbonyl)phenyl]urea?
1-[3-(cyclopropylmethoxy)propyl]-3-[2-(morpholine-4-carbonyl)phenyl]urea has a molecular weight of 361.44 g/mol, XLogP of 2.10, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(cyclopropylmethoxy)propyl]-3-[2-(morpholine-4-carbonyl)phenyl]urea is sourced from PubChem (CID 55698561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).