(3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone

C15H19N3O — CID 112531045

IUPAC(3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone
SMILESCn1ccc2cccc(C(=O)N3CCCC(N)C3)c21
InChIInChI=1S/C15H19N3O/c1-17-9-7-11-4-2-6-13(14(11)17)15(19)18-8-3-5-12(16)10-18/h2,4,6-7,9,12H,3,5,8,10,16H2,1H3
InChIKeyLDSVHPLVALPCKG-UHFFFAOYSA-N
MW257.34 g/mol
LogP1.74
Rot. Bonds1

About (3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone

(3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone (PubChem CID 112531045) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is (3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone.

Molecular Properties

Compound Name(3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone
PubChem CID112531045
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name(3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone
SMILESCn1ccc2cccc(C(=O)N3CCCC(N)C3)c21
InChIInChI=1S/C15H19N3O/c1-17-9-7-11-4-2-6-13(14(11)17)15(19)18-8-3-5-12(16)10-18/h2,4,6-7,9,12H,3,5,8,10,16H2,1H3
InChIKeyLDSVHPLVALPCKG-UHFFFAOYSA-N
XLogP1.74
TPSA51.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone
CID 112531165
3-[(3R)-3-aminopiperidine-1-carbonyl]-1-methylpyridin-2-one
CID 129493140
2-(3-aminopiperidine-1-carbonyl)benzoic acid
CID 61403703
(3-aminopiperidin-1-yl)-(4-methyl-1H-pyrrol-3-yl)methanone
CID 119377405
[(3S)-3-aminopiperidin-1-yl]-(2-methoxyphenyl)methanone
CID 129366272
(3-aminopiperidin-1-yl)-(2-methoxyphenyl)methanone;hydrochloride
CID 119381351
(3-aminopiperidin-1-yl)-(2-methyl-3-nitrophenyl)methanone;hydrochloride
CID 119377680
[(3R)-3-aminopiperidin-1-yl]-(2,6-difluorophenyl)methanone
CID 102978457
(3-aminopiperidin-1-yl)-(2-methyl-1H-pyrrol-3-yl)methanone
CID 119381286
[3-(hydroxymethyl)piperidin-1-yl]-(2-hydroxyphenyl)methanone
CID 43403148
[(3S)-3-aminopiperidin-1-yl]-(2,6-dichlorophenyl)methanone;hydrochloride
CID 176515188
[(3R)-3-aminopiperidin-1-yl]-[2-[bis(methylideneamino)amino]phenyl]methanone
CID 144636179

Frequently Asked Questions

What is the IUPAC name of (3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone?
The IUPAC name of (3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone (CID 112531045) is (3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone.
What is the SMILES notation for (3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone?
The canonical SMILES for (3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone is Cn1ccc2cccc(C(=O)N3CCCC(N)C3)c21.
What is the InChIKey of (3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone?
The InChIKey is LDSVHPLVALPCKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-17-9-7-11-4-2-6-13(14(11)17)15(19)18-8-3-5-12(16)10-18/h2,4,6-7,9,12H,3,5,8,10,16H2,1H3.
What are the key properties of (3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone?
(3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone has a molecular weight of 257.34 g/mol, XLogP of 1.74, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone is sourced from PubChem (CID 112531045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).