N-cyclopropyl-N-[[1-(2-methoxyphenyl)indol-3-yl]methyl]morpholine-2-carboxamide

C24H27N3O3 — CID 59494035

IUPACN-cyclopropyl-N-[[1-(2-methoxyphenyl)indol-3-yl]methyl]morpholine-2-carboxamide
SMILESCOc1ccccc1-n1cc(CN(C(=O)C2CNCCO2)C2CC2)c2ccccc21
InChIInChI=1S/C24H27N3O3/c1-29-22-9-5-4-8-21(22)27-16-17(19-6-2-3-7-20(19)27)15-26(18-10-11-18)24(28)23-14-25-12-13-30-23/h2-9,16,18,23,25H,10-15H2,1H3
InChIKeyVXAJVOPTIWIXOW-UHFFFAOYSA-N
MW405.50 g/mol
LogP3.12
Rot. Bonds6

About N-cyclopropyl-N-[[1-(2-methoxyphenyl)indol-3-yl]methyl]morpholine-2-carboxamide

N-cyclopropyl-N-[[1-(2-methoxyphenyl)indol-3-yl]methyl]morpholine-2-carboxamide (PubChem CID 59494035) has the molecular formula C24H27N3O3 and a molecular weight of 405.50 g/mol. Its IUPAC name is N-cyclopropyl-N-[[1-(2-methoxyphenyl)indol-3-yl]methyl]morpholine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[[1-(2-methoxyphenyl)indol-3-yl]methyl]morpholine-2-carboxamide
PubChem CID59494035
Molecular FormulaC24H27N3O3
Molecular Weight405.50 g/mol
Exact Mass405.21
IUPAC NameN-cyclopropyl-N-[[1-(2-methoxyphenyl)indol-3-yl]methyl]morpholine-2-carboxamide
SMILESCOc1ccccc1-n1cc(CN(C(=O)C2CNCCO2)C2CC2)c2ccccc21
InChIInChI=1S/C24H27N3O3/c1-29-22-9-5-4-8-21(22)27-16-17(19-6-2-3-7-20(19)27)15-26(18-10-11-18)24(28)23-14-25-12-13-30-23/h2-9,16,18,23,25H,10-15H2,1H3
InChIKeyVXAJVOPTIWIXOW-UHFFFAOYSA-N
XLogP3.12
TPSA55.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.50
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopentyl-N-[(2-methoxyphenyl)methyl]morpholine-2-carboxamide;hydrochloride
CID 154909292
N-cyclopropyl-N-[[1-[(3-methoxyphenyl)methyl]indol-3-yl]methyl]morpholine-2-carboxamide
CID 59494835
N-cyclopropyl-N-[[1-[3-(1,3-dioxoisoindol-2-yl)propyl]indol-3-yl]methyl]morpholine-2-carboxamide
CID 70905472
2-[3-[[cyclopropyl(morpholine-2-carboximidoyl)amino]methyl]indol-1-yl]-N-methoxyacetamide
CID 126583414
(2R)-N-cyclopropyl-N-[[4-(3-methoxypropoxy)naphthalen-2-yl]methyl]morpholine-2-carboxamide
CID 59494191
N-[(5-bromo-2-ethoxyphenyl)methyl]-N-cyclopropylmorpholine-2-carboxamide
CID 119776320
(2R)-N-cyclopropyl-N-[[1-(3-methoxypropyl)-4-phenylpyrrolo[2,3-b]pyridin-3-yl]methyl]morpholine-2-carboxamide
CID 59494309
N-cyclopropyl-N-[[4-(trifluoromethyl)phenyl]methyl]morpholine-2-carboxamide;hydrochloride
CID 119715128
(2R)-N-cyclopropyl-N-[[3-(3-methoxypropoxy)-5-phenylmethoxyphenyl]methyl]morpholine-2-carboxamide;hydrochloride
CID 67543478
(2S)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]morpholine-2-carboxamide
CID 124685793
N-[2-(2-methoxyphenyl)ethyl]morpholine-2-carboxamide
CID 103808140
N-(1-benzoylpiperidin-4-yl)-N-propylmorpholine-2-carboxamide
CID 119762655

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[[1-(2-methoxyphenyl)indol-3-yl]methyl]morpholine-2-carboxamide?
The IUPAC name of N-cyclopropyl-N-[[1-(2-methoxyphenyl)indol-3-yl]methyl]morpholine-2-carboxamide (CID 59494035) is N-cyclopropyl-N-[[1-(2-methoxyphenyl)indol-3-yl]methyl]morpholine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-[[1-(2-methoxyphenyl)indol-3-yl]methyl]morpholine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-N-[[1-(2-methoxyphenyl)indol-3-yl]methyl]morpholine-2-carboxamide is COc1ccccc1-n1cc(CN(C(=O)C2CNCCO2)C2CC2)c2ccccc21.
What is the InChIKey of N-cyclopropyl-N-[[1-(2-methoxyphenyl)indol-3-yl]methyl]morpholine-2-carboxamide?
The InChIKey is VXAJVOPTIWIXOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O3/c1-29-22-9-5-4-8-21(22)27-16-17(19-6-2-3-7-20(19)27)15-26(18-10-11-18)24(28)23-14-25-12-13-30-23/h2-9,16,18,23,25H,10-15H2,1H3.
What are the key properties of N-cyclopropyl-N-[[1-(2-methoxyphenyl)indol-3-yl]methyl]morpholine-2-carboxamide?
N-cyclopropyl-N-[[1-(2-methoxyphenyl)indol-3-yl]methyl]morpholine-2-carboxamide has a molecular weight of 405.50 g/mol, XLogP of 3.12, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[[1-(2-methoxyphenyl)indol-3-yl]methyl]morpholine-2-carboxamide is sourced from PubChem (CID 59494035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).