(3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone

C19H30N4O — CID 119381756

IUPAC(3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone
SMILESCC(C)N1CCN(c2ccc(C(=O)N3CCCC(N)C3)cc2)CC1
InChIInChI=1S/C19H30N4O/c1-15(2)21-10-12-22(13-11-21)18-7-5-16(6-8-18)19(24)23-9-3-4-17(20)14-23/h5-8,15,17H,3-4,9-14,20H2,1-2H3
InChIKeyRPYSYCYTBHVVJH-UHFFFAOYSA-N
MW330.48 g/mol
LogP1.78
Rot. Bonds3

About (3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone

(3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone (PubChem CID 119381756) has the molecular formula C19H30N4O and a molecular weight of 330.48 g/mol. Its IUPAC name is (3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone.

Molecular Properties

Compound Name(3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone
PubChem CID119381756
Molecular FormulaC19H30N4O
Molecular Weight330.48 g/mol
Exact Mass330.24
IUPAC Name(3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone
SMILESCC(C)N1CCN(c2ccc(C(=O)N3CCCC(N)C3)cc2)CC1
InChIInChI=1S/C19H30N4O/c1-15(2)21-10-12-22(13-11-21)18-7-5-16(6-8-18)19(24)23-9-3-4-17(20)14-23/h5-8,15,17H,3-4,9-14,20H2,1-2H3
InChIKeyRPYSYCYTBHVVJH-UHFFFAOYSA-N
XLogP1.78
TPSA52.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.48
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone with MolForge

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Related Compounds

[3-(methylaminomethyl)piperidin-1-yl]-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone;dihydrochloride
CID 119398891
[3-(methylamino)piperidin-1-yl]-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone
CID 119493758
1-(3-aminopiperidin-1-yl)-2-[4-(4-fluorophenyl)piperazin-1-yl]propan-1-one
CID 119380573
(4-amino-3,3-dimethylpiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone;dihydrochloride
CID 120817158
(2R)-1-[4-(4-propan-2-ylpiperazin-1-yl)benzoyl]pyrrolidine-2-carboxylic acid
CID 119371187
(3-aminopiperidin-1-yl)-(4-tert-butylphenyl)methanone;hydrochloride
CID 75526663
[(3R)-3-aminopiperidin-1-yl]-[4-(dimethylamino)phenyl]methanone
CID 102983493
4-(3-aminopiperidine-1-carbonyl)-N-propan-2-ylbenzenesulfonamide
CID 119380917
4-(3-aminopiperidine-1-carbonyl)-N-propan-2-ylbenzenesulfonamide;hydrochloride
CID 119380916
(3-aminopiperidin-1-yl)-(4-butan-2-yloxyphenyl)methanone;hydrochloride
CID 119380613
(3-aminopiperidin-1-yl)-(4-phenylphenyl)methanone;hydrochloride
CID 119381362
(3-aminopiperidin-1-yl)-(3,4-dimethylphenyl)methanone;hydrochloride
CID 119381443

Frequently Asked Questions

What is the IUPAC name of (3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone?
The IUPAC name of (3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone (CID 119381756) is (3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone.
What is the SMILES notation for (3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone?
The canonical SMILES for (3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone is CC(C)N1CCN(c2ccc(C(=O)N3CCCC(N)C3)cc2)CC1.
What is the InChIKey of (3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone?
The InChIKey is RPYSYCYTBHVVJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O/c1-15(2)21-10-12-22(13-11-21)18-7-5-16(6-8-18)19(24)23-9-3-4-17(20)14-23/h5-8,15,17H,3-4,9-14,20H2,1-2H3.
What are the key properties of (3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone?
(3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone has a molecular weight of 330.48 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminopiperidin-1-yl)-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]methanone is sourced from PubChem (CID 119381756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).