2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide

C15H32N4O — CID 79805247

IUPAC2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide
SMILESCCC(C)(N)C(=O)N(CCN(C)C)C1CCN(C)CC1
InChIInChI=1S/C15H32N4O/c1-6-15(2,16)14(20)19(12-11-17(3)4)13-7-9-18(5)10-8-13/h13H,6-12,16H2,1-5H3
InChIKeyFYBSBGNWIMMDCU-UHFFFAOYSA-N
MW284.45 g/mol
LogP0.60
Rot. Bonds6

About 2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide

2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide (PubChem CID 79805247) has the molecular formula C15H32N4O and a molecular weight of 284.45 g/mol. Its IUPAC name is 2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide.

Molecular Properties

Compound Name2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide
PubChem CID79805247
Molecular FormulaC15H32N4O
Molecular Weight284.45 g/mol
Exact Mass284.26
IUPAC Name2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide
SMILESCCC(C)(N)C(=O)N(CCN(C)C)C1CCN(C)CC1
InChIInChI=1S/C15H32N4O/c1-6-15(2,16)14(20)19(12-11-17(3)4)13-7-9-18(5)10-8-13/h13H,6-12,16H2,1-5H3
InChIKeyFYBSBGNWIMMDCU-UHFFFAOYSA-N
XLogP0.60
TPSA52.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.45
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)propanamide
CID 61266425
3-amino-N-[2-(dimethylamino)ethyl]-N-(1-methylpiperidin-4-yl)propanamide
CID 54873923
N-[2-(dimethylamino)ethyl]-N-(1-methylpiperidin-4-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 115950158
2-amino-N-(2-cyanoethyl)-N-cyclopropyl-2-methylbutanamide
CID 79804827
3-[2-(dimethylamino)ethyl-(1-methylpiperidin-4-yl)amino]-3-oxopropanoic acid
CID 62232103
2-amino-N,2-dimethyl-N-(1-propylpiperidin-4-yl)butanamide
CID 79805082
2-bromo-N-[2-(dimethylamino)ethyl]-N-(1-methylpiperidin-4-yl)propanamide
CID 114014439
3-[2-(dimethylamino)ethyl-(1-methylpiperidin-4-yl)amino]-2-methyl-3-oxopropanoic acid
CID 114897698
N-[2-(dimethylamino)ethyl]-4-hydroxy-N-(1-methylpiperidin-4-yl)butanamide
CID 79203320
3-amino-N-(2-hydroxyethyl)-2,2-dimethyl-N-(1-methylpiperidin-4-yl)propanamide
CID 113307593
2-(aminomethyl)-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-ethylbutanamide
CID 115432203
2-amino-N-[2-(dimethylamino)ethyl]-4-methyl-N-(1-methylpiperidin-4-yl)pentanamide
CID 60954174

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide?
The IUPAC name of 2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide (CID 79805247) is 2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide.
What is the SMILES notation for 2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide?
The canonical SMILES for 2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide is CCC(C)(N)C(=O)N(CCN(C)C)C1CCN(C)CC1.
What is the InChIKey of 2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide?
The InChIKey is FYBSBGNWIMMDCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N4O/c1-6-15(2,16)14(20)19(12-11-17(3)4)13-7-9-18(5)10-8-13/h13H,6-12,16H2,1-5H3.
What are the key properties of 2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide?
2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide has a molecular weight of 284.45 g/mol, XLogP of 0.60, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)butanamide is sourced from PubChem (CID 79805247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).