1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide

C23H27N3O — CID 134807365

IUPAC1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide
SMILESCN1CCC2(C1)CN(CC1CC1)c1ccc(C(=O)Nc3ccccc3)cc12
InChIInChI=1S/C23H27N3O/c1-25-12-11-23(15-25)16-26(14-17-7-8-17)21-10-9-18(13-20(21)23)22(27)24-19-5-3-2-4-6-19/h2-6,9-10,13,17H,7-8,11-12,14-16H2,1H3,(H,24,27)
InChIKeyKVCFAGCDGSSSDW-UHFFFAOYSA-N
MW361.49 g/mol
LogP3.74
Rot. Bonds4

About 1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide

1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide (PubChem CID 134807365) has the molecular formula C23H27N3O and a molecular weight of 361.49 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide
PubChem CID134807365
Molecular FormulaC23H27N3O
Molecular Weight361.49 g/mol
Exact Mass361.22
IUPAC Name1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide
SMILESCN1CCC2(C1)CN(CC1CC1)c1ccc(C(=O)Nc3ccccc3)cc12
InChIInChI=1S/C23H27N3O/c1-25-12-11-23(15-25)16-26(14-17-7-8-17)21-10-9-18(13-20(21)23)22(27)24-19-5-3-2-4-6-19/h2-6,9-10,13,17H,7-8,11-12,14-16H2,1H3,(H,24,27)
InChIKeyKVCFAGCDGSSSDW-UHFFFAOYSA-N
XLogP3.74
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.49
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1'-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide
CID 134809745
N-(3-hydroxypropyl)-1'-methyl-1-(oxan-4-ylmethyl)spiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide
CID 134808469
1'-(2-methoxyethyl)-1-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide
CID 134808150
N-(cyclopropylmethyl)-1'-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]spiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide
CID 134809965
N-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide
CID 134805432
8-(4-methylpiperazin-1-yl)-N-phenylnaphthalene-2-carboxamide
CID 54247739
7,7-dimethyl-N-phenyl-5,6,8,9-tetrahydrobenzo[7]annulene-3-carboxamide
CID 54464525
N-[(1R,9R)-10-(cyclopropylmethyl)-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-yl]benzamide
CID 101334599
2-(cyclopropylmethyl)-N-(3-methylphenyl)-3-oxo-2,7-diazaspiro[3.5]nonane-7-carboxamide
CID 97472874
N-[[1-[2-amino-5-(phenylcarbamoyl)phenyl]piperidin-4-yl]methyl]-methylboronamidic acid
CID 58056342
1,1'-dimethyl-N-(thiophen-2-ylmethyl)spiro[2H-indole-3,3'-piperidine]-5-carboxamide
CID 134806768
3-[[2-(cyclopropylmethylamino)acetyl]amino]-4-methyl-N-phenylbenzamide;hydrochloride
CID 119712027

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide?
The IUPAC name of 1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide (CID 134807365) is 1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide.
What is the SMILES notation for 1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide?
The canonical SMILES for 1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide is CN1CCC2(C1)CN(CC1CC1)c1ccc(C(=O)Nc3ccccc3)cc12.
What is the InChIKey of 1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide?
The InChIKey is KVCFAGCDGSSSDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N3O/c1-25-12-11-23(15-25)16-26(14-17-7-8-17)21-10-9-18(13-20(21)23)22(27)24-19-5-3-2-4-6-19/h2-6,9-10,13,17H,7-8,11-12,14-16H2,1H3,(H,24,27).
What are the key properties of 1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide?
1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide has a molecular weight of 361.49 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide is sourced from PubChem (CID 134807365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).