3-[4-(aminomethyl)-4-methylpiperidin-1-yl]propanamide

C10H21N3O — CID 107160625

IUPAC3-[4-(aminomethyl)-4-methylpiperidin-1-yl]propanamide
SMILESCC1(CN)CCN(CCC(N)=O)CC1
InChIInChI=1S/C10H21N3O/c1-10(8-11)3-6-13(7-4-10)5-2-9(12)14/h2-8,11H2,1H3,(H2,12,14)
InChIKeyVDKRLKDFAZHZNK-UHFFFAOYSA-N
MW199.30 g/mol
LogP-0.08
Rot. Bonds4

About 3-[4-(aminomethyl)-4-methylpiperidin-1-yl]propanamide

3-[4-(aminomethyl)-4-methylpiperidin-1-yl]propanamide (PubChem CID 107160625) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 3-[4-(aminomethyl)-4-methylpiperidin-1-yl]propanamide.

Molecular Properties

Compound Name3-[4-(aminomethyl)-4-methylpiperidin-1-yl]propanamide
PubChem CID107160625
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name3-[4-(aminomethyl)-4-methylpiperidin-1-yl]propanamide
SMILESCC1(CN)CCN(CCC(N)=O)CC1
InChIInChI=1S/C10H21N3O/c1-10(8-11)3-6-13(7-4-10)5-2-9(12)14/h2-8,11H2,1H3,(H2,12,14)
InChIKeyVDKRLKDFAZHZNK-UHFFFAOYSA-N
XLogP-0.08
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[4-methyl-4-(methylamino)piperidin-1-yl]propanamide
CID 115304874
2-[3-(aminomethyl)-3-methylpyrrolidin-1-yl]acetamide
CID 130562485
3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide
CID 131000731
[1-[2-(2-methoxyethoxy)ethyl]-4-methylpiperidin-4-yl]methanamine
CID 107160604
2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-1-(azepan-1-yl)ethanone
CID 107160703
3-[3-(aminomethyl)-3-methylpyrrolidin-1-yl]-1-morpholin-4-ylpropan-1-one;hydrochloride
CID 120772197
[4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methanamine
CID 107160540
[4-methyl-1-(2-propoxyethyl)piperidin-4-yl]methanamine
CID 107160532
1-[4-(aminomethyl)-4-methylpiperidin-1-yl]-2-methylpropan-1-one
CID 107160042
3-[3-(aminomethyl)-3-methylpyrrolidin-1-yl]-N-phenylpropanamide
CID 120771754
4-[3-[3-(aminomethyl)-3-methylpyrrolidin-1-yl]propanoylamino]benzamide;hydrochloride
CID 120772509
2-[3-(aminomethyl)-3-methylpyrrolidin-1-yl]acetohydrazide
CID 130562628

Frequently Asked Questions

What is the IUPAC name of 3-[4-(aminomethyl)-4-methylpiperidin-1-yl]propanamide?
The IUPAC name of 3-[4-(aminomethyl)-4-methylpiperidin-1-yl]propanamide (CID 107160625) is 3-[4-(aminomethyl)-4-methylpiperidin-1-yl]propanamide.
What is the SMILES notation for 3-[4-(aminomethyl)-4-methylpiperidin-1-yl]propanamide?
The canonical SMILES for 3-[4-(aminomethyl)-4-methylpiperidin-1-yl]propanamide is CC1(CN)CCN(CCC(N)=O)CC1.
What is the InChIKey of 3-[4-(aminomethyl)-4-methylpiperidin-1-yl]propanamide?
The InChIKey is VDKRLKDFAZHZNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-10(8-11)3-6-13(7-4-10)5-2-9(12)14/h2-8,11H2,1H3,(H2,12,14).
What are the key properties of 3-[4-(aminomethyl)-4-methylpiperidin-1-yl]propanamide?
3-[4-(aminomethyl)-4-methylpiperidin-1-yl]propanamide has a molecular weight of 199.30 g/mol, XLogP of -0.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(aminomethyl)-4-methylpiperidin-1-yl]propanamide is sourced from PubChem (CID 107160625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).