N-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide

C14H29N3O — CID 107147671

IUPACN-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide
SMILESCC(CCN(C)C)NC(=O)CC1NCCCC1C
InChIInChI=1S/C14H29N3O/c1-11-6-5-8-15-13(11)10-14(18)16-12(2)7-9-17(3)4/h11-13,15H,5-10H2,1-4H3,(H,16,18)
InChIKeyBYEKWEVZRGMGER-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.22
Rot. Bonds6

About N-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide

N-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide (PubChem CID 107147671) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is N-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide.

Molecular Properties

Compound NameN-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide
PubChem CID107147671
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC NameN-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide
SMILESCC(CCN(C)C)NC(=O)CC1NCCCC1C
InChIInChI=1S/C14H29N3O/c1-11-6-5-8-15-13(11)10-14(18)16-12(2)7-9-17(3)4/h11-13,15H,5-10H2,1-4H3,(H,16,18)
InChIKeyBYEKWEVZRGMGER-UHFFFAOYSA-N
XLogP1.22
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methylpiperidin-2-yl)-N-[1-(oxolan-2-yl)ethyl]acetamide
CID 107147559
N-(5-methylhexyl)-2-(3-methylpiperidin-2-yl)acetamide
CID 107147985
N,N-dimethyl-2-(3-methylpiperidin-2-yl)acetamide
CID 107147512
N-(2-methylcyclohexyl)-2-(3-methylpiperidin-2-yl)acetamide
CID 107147462
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[4-(dimethylamino)butan-2-yl]acetamide
CID 79607442
N-(3-methylcyclopentyl)-2-(3-methylpiperidin-2-yl)acetamide
CID 107148093
N-(3-methylpentan-3-yl)-2-(3-methylpiperidin-2-yl)acetamide
CID 114174284
2-(cyclopentylamino)-N-[4-(dimethylamino)butan-2-yl]acetamide
CID 54968434
N-(2-methoxyethyl)-2-(3-methylpiperidin-2-yl)-N-propan-2-ylacetamide
CID 107148002
1,1-dimethyl-3-[(3-methylpiperidin-2-yl)methyl]urea
CID 79154184
1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-(3-methylpiperidin-2-yl)ethanone
CID 107148097
N,N-dibutyl-2-(3-methylpiperidin-2-yl)acetamide
CID 107147528

Frequently Asked Questions

What is the IUPAC name of N-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide?
The IUPAC name of N-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide (CID 107147671) is N-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide.
What is the SMILES notation for N-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide?
The canonical SMILES for N-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide is CC(CCN(C)C)NC(=O)CC1NCCCC1C.
What is the InChIKey of N-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide?
The InChIKey is BYEKWEVZRGMGER-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-11-6-5-8-15-13(11)10-14(18)16-12(2)7-9-17(3)4/h11-13,15H,5-10H2,1-4H3,(H,16,18).
What are the key properties of N-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide?
N-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide has a molecular weight of 255.41 g/mol, XLogP of 1.22, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(dimethylamino)butan-2-yl]-2-(3-methylpiperidin-2-yl)acetamide is sourced from PubChem (CID 107147671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).