N,N-diethyl-4-(2-pyrrolidin-2-ylpiperidin-1-yl)butanamide

C17H33N3O — CID 63256599

IUPACN,N-diethyl-4-(2-pyrrolidin-2-ylpiperidin-1-yl)butanamide
SMILESCCN(CC)C(=O)CCCN1CCCCC1C1CCCN1
InChIInChI=1S/C17H33N3O/c1-3-19(4-2)17(21)11-8-14-20-13-6-5-10-16(20)15-9-7-12-18-15/h15-16,18H,3-14H2,1-2H3
InChIKeyZPZCFWQWQBWATO-UHFFFAOYSA-N
MW295.47 g/mol
LogP2.24
Rot. Bonds7

About N,N-diethyl-4-(2-pyrrolidin-2-ylpiperidin-1-yl)butanamide

N,N-diethyl-4-(2-pyrrolidin-2-ylpiperidin-1-yl)butanamide (PubChem CID 63256599) has the molecular formula C17H33N3O and a molecular weight of 295.47 g/mol. Its IUPAC name is N,N-diethyl-4-(2-pyrrolidin-2-ylpiperidin-1-yl)butanamide.

Molecular Properties

Compound NameN,N-diethyl-4-(2-pyrrolidin-2-ylpiperidin-1-yl)butanamide
PubChem CID63256599
Molecular FormulaC17H33N3O
Molecular Weight295.47 g/mol
Exact Mass295.26
IUPAC NameN,N-diethyl-4-(2-pyrrolidin-2-ylpiperidin-1-yl)butanamide
SMILESCCN(CC)C(=O)CCCN1CCCCC1C1CCCN1
InChIInChI=1S/C17H33N3O/c1-3-19(4-2)17(21)11-8-14-20-13-6-5-10-16(20)15-9-7-12-18-15/h15-16,18H,3-14H2,1-2H3
InChIKeyZPZCFWQWQBWATO-UHFFFAOYSA-N
XLogP2.24
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.47
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-[(2R)-piperidin-2-yl]but-2-ynyl]pyrrolidin-2-one
CID 71460014
(2S)-2,6-diamino-1-[4-(pentadecylamino)piperidin-1-yl]hexan-1-one
CID 44592860
(2S)-2,6-diamino-N-[2-[4-(pentadecylamino)piperidin-1-yl]ethyl]hexanamide
CID 44592861
(S)-Pyrrolidine-2-carboxylic acid hexadecylamide
CID 9927834
Pyrrolidine-2-carboxylic acid hexadecylamide
CID 14373245
1-[2-(Aminomethyl)piperidin-1-yl]tetradecan-1-one
CID 15072976
2-amino-N-[(1-tridecanoylpiperidin-2-yl)methyl]acetamide
CID 19778224
2-(2-methyl-5-oxo-1-pyrrolidinyl)-N-[2-(1-piperidinyl)propyl]acetamide
CID 21327783
cis-N-[2-(2,6-dimethyl-1-piperidinyl)ethyl]-2-oxo-1-pyrrolidineacetamide
CID 44374502
N-[2-(2,6-dimethyl-1-piperidinyl)ethyl]-2-(2-methyl-5-oxo-1-pyrrolidinyl)acetamide
CID 44374529
(2S)-N-[4-(dodecylamino)-4-oxobutyl]pyrrolidine-2-carboxamide
CID 67813298
1-(Piperidin-3-yl)pyrrolidin-2-one
CID 24689384

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-(2-pyrrolidin-2-ylpiperidin-1-yl)butanamide?
The IUPAC name of N,N-diethyl-4-(2-pyrrolidin-2-ylpiperidin-1-yl)butanamide (CID 63256599) is N,N-diethyl-4-(2-pyrrolidin-2-ylpiperidin-1-yl)butanamide.
What is the SMILES notation for N,N-diethyl-4-(2-pyrrolidin-2-ylpiperidin-1-yl)butanamide?
The canonical SMILES for N,N-diethyl-4-(2-pyrrolidin-2-ylpiperidin-1-yl)butanamide is CCN(CC)C(=O)CCCN1CCCCC1C1CCCN1.
What is the InChIKey of N,N-diethyl-4-(2-pyrrolidin-2-ylpiperidin-1-yl)butanamide?
The InChIKey is ZPZCFWQWQBWATO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3O/c1-3-19(4-2)17(21)11-8-14-20-13-6-5-10-16(20)15-9-7-12-18-15/h15-16,18H,3-14H2,1-2H3.
What are the key properties of N,N-diethyl-4-(2-pyrrolidin-2-ylpiperidin-1-yl)butanamide?
N,N-diethyl-4-(2-pyrrolidin-2-ylpiperidin-1-yl)butanamide has a molecular weight of 295.47 g/mol, XLogP of 2.24, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-(2-pyrrolidin-2-ylpiperidin-1-yl)butanamide is sourced from PubChem (CID 63256599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).