N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide

C19H28N2O4 — CID 119721132

IUPACN-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide
SMILESCOc1cc(C(C)NC(=O)C2COCCN2)ccc1OC1CCCC1
InChIInChI=1S/C19H28N2O4/c1-13(21-19(22)16-12-24-10-9-20-16)14-7-8-17(18(11-14)23-2)25-15-5-3-4-6-15/h7-8,11,13,15-16,20H,3-6,9-10,12H2,1-2H3,(H,21,22)
InChIKeyNWOKVVDTEXPVKL-UHFFFAOYSA-N
MW348.44 g/mol
LogP2.18
Rot. Bonds6

About N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide

N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide (PubChem CID 119721132) has the molecular formula C19H28N2O4 and a molecular weight of 348.44 g/mol. Its IUPAC name is N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide
PubChem CID119721132
Molecular FormulaC19H28N2O4
Molecular Weight348.44 g/mol
Exact Mass348.20
IUPAC NameN-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide
SMILESCOc1cc(C(C)NC(=O)C2COCCN2)ccc1OC1CCCC1
InChIInChI=1S/C19H28N2O4/c1-13(21-19(22)16-12-24-10-9-20-16)14-7-8-17(18(11-14)23-2)25-15-5-3-4-6-15/h7-8,11,13,15-16,20H,3-6,9-10,12H2,1-2H3,(H,21,22)
InChIKeyNWOKVVDTEXPVKL-UHFFFAOYSA-N
XLogP2.18
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.44
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(3-methoxy-4-propan-2-yloxyphenyl)ethyl]morpholine-3-carboxamide
CID 119721184
N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]pyrrolidine-3-carboxamide
CID 119721176
N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]piperidine-3-carboxamide
CID 119288176
(3R)-N-[(1S)-1-phenylethyl]morpholine-3-carboxamide
CID 16681349
N-[1-(3-fluoro-4-methoxyphenyl)ethyl]piperidine-2-carboxamide
CID 43709599
N-[1-[3-methoxy-4-(2-methoxyethoxy)phenyl]ethyl]pyrrolidine-2-carboxamide
CID 119289128
(2R)-N-[1-(3-bromo-4-methoxyphenyl)ethyl]piperidine-2-carboxamide;hydrochloride
CID 119694031
(2S)-N-[1-(3-bromo-4-methoxyphenyl)ethyl]piperidine-2-carboxamide;hydrochloride
CID 119694047
5-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethylcarbamoyl]pyrazine-2-carboxylic acid
CID 120684986
(1R)-1-[3-methoxy-4-(oxan-3-yloxy)phenyl]ethanol
CID 107135071
(2R)-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]pyrrolidine-2-carboxamide
CID 103794212
4-amino-N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]butanamide
CID 119288180

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide?
The IUPAC name of N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide (CID 119721132) is N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide.
What is the SMILES notation for N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide?
The canonical SMILES for N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide is COc1cc(C(C)NC(=O)C2COCCN2)ccc1OC1CCCC1.
What is the InChIKey of N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide?
The InChIKey is NWOKVVDTEXPVKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O4/c1-13(21-19(22)16-12-24-10-9-20-16)14-7-8-17(18(11-14)23-2)25-15-5-3-4-6-15/h7-8,11,13,15-16,20H,3-6,9-10,12H2,1-2H3,(H,21,22).
What are the key properties of N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide?
N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide has a molecular weight of 348.44 g/mol, XLogP of 2.18, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-cyclopentyloxy-3-methoxyphenyl)ethyl]morpholine-3-carboxamide is sourced from PubChem (CID 119721132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).