(3R)-N-(1-methylindol-6-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide

C19H26N4O — CID 99820655

IUPAC(3R)-N-(1-methylindol-6-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide
SMILESCn1ccc2ccc(NC(=O)N3CC[C@H](CN4CCCC4)C3)cc21
InChIInChI=1S/C19H26N4O/c1-21-10-7-16-4-5-17(12-18(16)21)20-19(24)23-11-6-15(14-23)13-22-8-2-3-9-22/h4-5,7,10,12,15H,2-3,6,8-9,11,13-14H2,1H3,(H,20,24)/t15-/m1/s1
InChIKeyFUPLWMKFYUUZLK-OAHLLOKOSA-N
MW326.44 g/mol
LogP3.13
Rot. Bonds3

About (3R)-N-(1-methylindol-6-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide

(3R)-N-(1-methylindol-6-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide (PubChem CID 99820655) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is (3R)-N-(1-methylindol-6-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(3R)-N-(1-methylindol-6-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide
PubChem CID99820655
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC Name(3R)-N-(1-methylindol-6-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide
SMILESCn1ccc2ccc(NC(=O)N3CC[C@H](CN4CCCC4)C3)cc21
InChIInChI=1S/C19H26N4O/c1-21-10-7-16-4-5-17(12-18(16)21)20-19(24)23-11-6-15(14-23)13-22-8-2-3-9-22/h4-5,7,10,12,15H,2-3,6,8-9,11,13-14H2,1H3,(H,20,24)/t15-/m1/s1
InChIKeyFUPLWMKFYUUZLK-OAHLLOKOSA-N
XLogP3.13
TPSA40.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-methylindol-6-yl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carboxamide
CID 122143234
N-(4-acetamidophenyl)-3-(piperidin-1-ylmethyl)pyrrolidine-1-carboxamide
CID 86800649
N-(3,4-difluorophenyl)-3-(piperidin-1-ylmethyl)pyrrolidine-1-carboxamide
CID 146127673
N-(3-fluoro-5-methylphenyl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide
CID 75442945
N-[4-(3-methoxyphenoxy)phenyl]-3-(piperidin-1-ylmethyl)pyrrolidine-1-carboxamide
CID 136534290
4-(azepan-1-ylmethyl)-N-(4-methylphenyl)piperidine-1-carboxamide
CID 20907581
3-(hydroxymethyl)-N-(1-propylindol-6-yl)piperidine-1-carboxamide
CID 111474969
3-methyl-1-[(1-methylindol-6-yl)carbamoyl]pyrrolidine-3-carboxylic acid
CID 122091024
N-(1-ethylindol-6-yl)pyrrolidine-1-carboxamide
CID 71874521
4-(azepan-1-ylmethyl)-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]piperidine-1-carboxamide
CID 47041694
(3S)-3-methylsulfonyl-N-(1-propylindol-6-yl)pyrrolidine-1-carboxamide
CID 125141718
N-(2-fluorophenyl)-3-(piperidin-1-ylmethyl)pyrrolidine-1-carboxamide
CID 146127859

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(1-methylindol-6-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide?
The IUPAC name of (3R)-N-(1-methylindol-6-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide (CID 99820655) is (3R)-N-(1-methylindol-6-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for (3R)-N-(1-methylindol-6-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide?
The canonical SMILES for (3R)-N-(1-methylindol-6-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide is Cn1ccc2ccc(NC(=O)N3CC[C@H](CN4CCCC4)C3)cc21.
What is the InChIKey of (3R)-N-(1-methylindol-6-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide?
The InChIKey is FUPLWMKFYUUZLK-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H26N4O/c1-21-10-7-16-4-5-17(12-18(16)21)20-19(24)23-11-6-15(14-23)13-22-8-2-3-9-22/h4-5,7,10,12,15H,2-3,6,8-9,11,13-14H2,1H3,(H,20,24)/t15-/m1/s1.
What are the key properties of (3R)-N-(1-methylindol-6-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide?
(3R)-N-(1-methylindol-6-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide has a molecular weight of 326.44 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(1-methylindol-6-yl)-3-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 99820655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).