3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide

C11H23N3O — CID 115153050

IUPAC3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide
SMILESCN1CCCC(CCNC(=O)CCN)C1
InChIInChI=1S/C11H23N3O/c1-14-8-2-3-10(9-14)5-7-13-11(15)4-6-12/h10H,2-9,12H2,1H3,(H,13,15)
InChIKeyYXMHLHMJRKGDPO-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.18
Rot. Bonds5

About 3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide

3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide (PubChem CID 115153050) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide.

Molecular Properties

Compound Name3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide
PubChem CID115153050
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide
SMILESCN1CCCC(CCNC(=O)CCN)C1
InChIInChI=1S/C11H23N3O/c1-14-8-2-3-10(9-14)5-7-13-11(15)4-6-12/h10H,2-9,12H2,1H3,(H,13,15)
InChIKeyYXMHLHMJRKGDPO-UHFFFAOYSA-N
XLogP0.18
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-methylpiperidin-3-yl)ethylurea
CID 115168583
N-[2-[(3S)-1-methylpiperidin-3-yl]ethyl]-3-(oxazinan-2-yl)propanamide
CID 95188582
N-[2-(1-methylpiperidin-3-yl)ethyl]-2-propan-2-ylsulfanylacetamide
CID 56714335
N-[2-[(3S)-1-methylpiperidin-3-yl]ethyl]-2-propan-2-ylsulfanylacetamide
CID 95207648
2-amino-2-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide
CID 115152765
4-[2-(1-methylpyrrolidin-3-yl)ethylamino]-4-oxobutanoic acid
CID 115163740
ethyl 2-[2-(1-methylpiperidin-3-yl)ethylamino]-2-oxoacetate
CID 115142076
4-amino-N-[2-(1-methylpiperidin-4-yl)ethyl]butanamide;dihydrochloride
CID 119865945
N-[2-(1-methylpiperidin-3-yl)ethyl]-2-(1,2,3,6-tetrahydropyridin-4-yl)acetamide
CID 56714892
(E)-4-[2-(1-methylpiperidin-3-yl)ethylamino]-4-oxobut-2-enoic acid
CID 115177299
3-[(1-methylpiperidin-3-yl)methylamino]-N-propylpropanamide
CID 62659462
3-[[2-(1-methylpiperidin-3-yl)acetyl]amino]propanoic acid
CID 110837529

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide?
The IUPAC name of 3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide (CID 115153050) is 3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide.
What is the SMILES notation for 3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide?
The canonical SMILES for 3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide is CN1CCCC(CCNC(=O)CCN)C1.
What is the InChIKey of 3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide?
The InChIKey is YXMHLHMJRKGDPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-14-8-2-3-10(9-14)5-7-13-11(15)4-6-12/h10H,2-9,12H2,1H3,(H,13,15).
What are the key properties of 3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide?
3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide has a molecular weight of 213.32 g/mol, XLogP of 0.18, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(1-methylpiperidin-3-yl)ethyl]propanamide is sourced from PubChem (CID 115153050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).