3-(piperidin-2-ylmethylamino)butanamide

C10H21N3O — CID 106634453

IUPAC3-(piperidin-2-ylmethylamino)butanamide
SMILESCC(CC(N)=O)NCC1CCCCN1
InChIInChI=1S/C10H21N3O/c1-8(6-10(11)14)13-7-9-4-2-3-5-12-9/h8-9,12-13H,2-7H2,1H3,(H2,11,14)
InChIKeyOOUODIFWYFAMAO-UHFFFAOYSA-N
MW199.30 g/mol
LogP-0.02
Rot. Bonds5

About 3-(piperidin-2-ylmethylamino)butanamide

3-(piperidin-2-ylmethylamino)butanamide (PubChem CID 106634453) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 3-(piperidin-2-ylmethylamino)butanamide.

Molecular Properties

Compound Name3-(piperidin-2-ylmethylamino)butanamide
PubChem CID106634453
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name3-(piperidin-2-ylmethylamino)butanamide
SMILESCC(CC(N)=O)NCC1CCCCN1
InChIInChI=1S/C10H21N3O/c1-8(6-10(11)14)13-7-9-4-2-3-5-12-9/h8-9,12-13H,2-7H2,1H3,(H2,11,14)
InChIKeyOOUODIFWYFAMAO-UHFFFAOYSA-N
XLogP-0.02
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 5-0.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

methyl (2S)-3-methyl-2-(piperidin-2-ylmethylamino)butanoate
CID 106633362
N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine
CID 59332807
4-methyl-N-(piperidin-2-ylmethyl)hexan-2-amine
CID 106634056
3-methyl-2-(piperidin-2-ylmethylamino)butanoic acid
CID 106633804
3-(cyclobutylmethylamino)butanamide
CID 115676578
N-(piperidin-2-ylmethyl)hexan-2-amine
CID 62199509
2-(1-pyrrolidin-2-ylpropan-2-ylamino)acetamide
CID 79544229
tert-butyl N-[2-(piperidin-2-ylmethylamino)propyl]carbamate
CID 107248267
methyl 4-methyl-2-(pyrrolidin-2-ylmethylamino)pentanoate
CID 14048585
N-(cyclobutylmethyl)-1-piperidin-2-ylpropan-2-amine
CID 79549693
3-methyl-N-(piperidin-2-ylmethyl)pentanamide
CID 114874123
3-[1-(azepan-2-yl)propan-2-ylamino]-2,2-dimethylpropanamide
CID 106274610

Frequently Asked Questions

What is the IUPAC name of 3-(piperidin-2-ylmethylamino)butanamide?
The IUPAC name of 3-(piperidin-2-ylmethylamino)butanamide (CID 106634453) is 3-(piperidin-2-ylmethylamino)butanamide.
What is the SMILES notation for 3-(piperidin-2-ylmethylamino)butanamide?
The canonical SMILES for 3-(piperidin-2-ylmethylamino)butanamide is CC(CC(N)=O)NCC1CCCCN1.
What is the InChIKey of 3-(piperidin-2-ylmethylamino)butanamide?
The InChIKey is OOUODIFWYFAMAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-8(6-10(11)14)13-7-9-4-2-3-5-12-9/h8-9,12-13H,2-7H2,1H3,(H2,11,14).
What are the key properties of 3-(piperidin-2-ylmethylamino)butanamide?
3-(piperidin-2-ylmethylamino)butanamide has a molecular weight of 199.30 g/mol, XLogP of -0.02, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(piperidin-2-ylmethylamino)butanamide is sourced from PubChem (CID 106634453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).