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

C14H29N3O2 — CID 79203320

IUPACN-[2-(dimethylamino)ethyl]-4-hydroxy-N-(1-methylpiperidin-4-yl)butanamide
SMILESCN(C)CCN(C(=O)CCCO)C1CCN(C)CC1
InChIInChI=1S/C14H29N3O2/c1-15(2)10-11-17(14(19)5-4-12-18)13-6-8-16(3)9-7-13/h13,18H,4-12H2,1-3H3
InChIKeyCQPCUIZYEUVBQH-UHFFFAOYSA-N
MW271.40 g/mol
LogP0.24
Rot. Bonds7

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

N-[2-(dimethylamino)ethyl]-4-hydroxy-N-(1-methylpiperidin-4-yl)butanamide (PubChem CID 79203320) has the molecular formula C14H29N3O2 and a molecular weight of 271.40 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-4-hydroxy-N-(1-methylpiperidin-4-yl)butanamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-4-hydroxy-N-(1-methylpiperidin-4-yl)butanamide
PubChem CID79203320
Molecular FormulaC14H29N3O2
Molecular Weight271.40 g/mol
Exact Mass271.23
IUPAC NameN-[2-(dimethylamino)ethyl]-4-hydroxy-N-(1-methylpiperidin-4-yl)butanamide
SMILESCN(C)CCN(C(=O)CCCO)C1CCN(C)CC1
InChIInChI=1S/C14H29N3O2/c1-15(2)10-11-17(14(19)5-4-12-18)13-6-8-16(3)9-7-13/h13,18H,4-12H2,1-3H3
InChIKeyCQPCUIZYEUVBQH-UHFFFAOYSA-N
XLogP0.24
TPSA47.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[2-(dimethylamino)ethyl-(1-methylpiperidin-4-yl)amino]-5-oxopentanoic acid
CID 60950165
N-cyclopentyl-N-[2-(dimethylamino)ethyl]-4-hydroxybutanamide
CID 79205212
5-chloro-N-[2-(dimethylamino)ethyl]-N-(1-methylpiperidin-4-yl)pentanamide
CID 60948355
3-amino-N-[2-(dimethylamino)ethyl]-N-(1-methylpiperidin-4-yl)propanamide
CID 54873923
3-[2-(dimethylamino)ethyl-(1-methylpiperidin-4-yl)amino]-3-oxopropanoic acid
CID 62232103
N-[2-(dimethylamino)ethyl]-N-(1-methylpiperidin-4-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 115950158
2-bromo-N-[2-(dimethylamino)ethyl]-N-(1-methylpiperidin-4-yl)propanamide
CID 114014439
2-amino-N-[2-(dimethylamino)ethyl]-2-methyl-N-(1-methylpiperidin-4-yl)propanamide
CID 61266425
3-(ethylamino)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)propanamide
CID 55121337
N-cyclopropyl-4-hydroxy-N-(2-methoxyethyl)butanamide
CID 79203731
7-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]heptanamide
CID 60954276
3-[2-(dimethylamino)ethyl-(1-methylpiperidin-4-yl)amino]-2-methyl-3-oxopropanoic acid
CID 114897698

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-4-hydroxy-N-(1-methylpiperidin-4-yl)butanamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-4-hydroxy-N-(1-methylpiperidin-4-yl)butanamide (CID 79203320) is N-[2-(dimethylamino)ethyl]-4-hydroxy-N-(1-methylpiperidin-4-yl)butanamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-4-hydroxy-N-(1-methylpiperidin-4-yl)butanamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-4-hydroxy-N-(1-methylpiperidin-4-yl)butanamide is CN(C)CCN(C(=O)CCCO)C1CCN(C)CC1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-4-hydroxy-N-(1-methylpiperidin-4-yl)butanamide?
The InChIKey is CQPCUIZYEUVBQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O2/c1-15(2)10-11-17(14(19)5-4-12-18)13-6-8-16(3)9-7-13/h13,18H,4-12H2,1-3H3.
What are the key properties of N-[2-(dimethylamino)ethyl]-4-hydroxy-N-(1-methylpiperidin-4-yl)butanamide?
N-[2-(dimethylamino)ethyl]-4-hydroxy-N-(1-methylpiperidin-4-yl)butanamide has a molecular weight of 271.40 g/mol, XLogP of 0.24, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-4-hydroxy-N-(1-methylpiperidin-4-yl)butanamide is sourced from PubChem (CID 79203320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).