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

C15H19N3O — CID 112531165

IUPAC(4-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone
SMILESCn1ccc2cccc(C(=O)N3CCC(N)CC3)c21
InChIInChI=1S/C15H19N3O/c1-17-8-5-11-3-2-4-13(14(11)17)15(19)18-9-6-12(16)7-10-18/h2-5,8,12H,6-7,9-10,16H2,1H3
InChIKeyBGQWOYSBMBCWRU-UHFFFAOYSA-N
MW257.34 g/mol
LogP1.74
Rot. Bonds1

About (4-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone

(4-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone (PubChem CID 112531165) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is (4-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone.

Molecular Properties

Compound Name(4-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone
PubChem CID112531165
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name(4-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone
SMILESCn1ccc2cccc(C(=O)N3CCC(N)CC3)c21
InChIInChI=1S/C15H19N3O/c1-17-8-5-11-3-2-4-13(14(11)17)15(19)18-9-6-12(16)7-10-18/h2-5,8,12H,6-7,9-10,16H2,1H3
InChIKeyBGQWOYSBMBCWRU-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

(3-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone
CID 112531045
(4-aminopiperidin-1-yl)-(2-methylphenyl)methanone;hydrochloride
CID 119372796
(4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride
CID 119375001
(4-aminopiperidin-1-yl)-(2-phenoxyphenyl)methanone
CID 119373846
(4-aminopiperidin-1-yl)-(2,6-dimethyl-3-pyridinyl)methanone
CID 62829888
(4-aminopiperidin-1-yl)-[2-(trifluoromethyl)phenyl]methanone;hydrochloride
CID 86276608
(4-aminopiperidin-1-yl)-(2-methyl-1H-pyrrol-3-yl)methanone
CID 119376460
(4-aminopiperidin-1-yl)-(2-anilinophenyl)methanone
CID 119373306
[3-(4-aminopiperidin-1-yl)pyrrolidin-1-yl]-(1-methylpyrrol-2-yl)methanone
CID 80553966
(3-aminopyrrolidin-1-yl)-(1-methylindol-6-yl)methanone
CID 112530856
(2-amino-3-methylphenyl)-[4-(hydroxymethyl)piperidin-1-yl]methanone
CID 43133107
N-[3-[7-[(3S)-3-methylpyrrolidine-1-carbonyl]indol-1-yl]propyl]methanesulfonamide
CID 142015059

Frequently Asked Questions

What is the IUPAC name of (4-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone?
The IUPAC name of (4-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone (CID 112531165) is (4-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone.
What is the SMILES notation for (4-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone?
The canonical SMILES for (4-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone is Cn1ccc2cccc(C(=O)N3CCC(N)CC3)c21.
What is the InChIKey of (4-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone?
The InChIKey is BGQWOYSBMBCWRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-17-8-5-11-3-2-4-13(14(11)17)15(19)18-9-6-12(16)7-10-18/h2-5,8,12H,6-7,9-10,16H2,1H3.
What are the key properties of (4-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone?
(4-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 (4-aminopiperidin-1-yl)-(1-methylindol-7-yl)methanone is sourced from PubChem (CID 112531165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).