2-[4-(1-aminoethyl)piperidin-1-yl]-N,N-dipropylacetamide

C15H31N3O — CID 55217068

IUPAC2-[4-(1-aminoethyl)piperidin-1-yl]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)CN1CCC(C(C)N)CC1
InChIInChI=1S/C15H31N3O/c1-4-8-18(9-5-2)15(19)12-17-10-6-14(7-11-17)13(3)16/h13-14H,4-12,16H2,1-3H3
InChIKeyMNQTWKRSJBVSRC-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.69
Rot. Bonds7

About 2-[4-(1-aminoethyl)piperidin-1-yl]-N,N-dipropylacetamide

2-[4-(1-aminoethyl)piperidin-1-yl]-N,N-dipropylacetamide (PubChem CID 55217068) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 2-[4-(1-aminoethyl)piperidin-1-yl]-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-[4-(1-aminoethyl)piperidin-1-yl]-N,N-dipropylacetamide
PubChem CID55217068
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name2-[4-(1-aminoethyl)piperidin-1-yl]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)CN1CCC(C(C)N)CC1
InChIInChI=1S/C15H31N3O/c1-4-8-18(9-5-2)15(19)12-17-10-6-14(7-11-17)13(3)16/h13-14H,4-12,16H2,1-3H3
InChIKeyMNQTWKRSJBVSRC-UHFFFAOYSA-N
XLogP1.69
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[2-(dimethylamino)ethyl]piperidin-1-yl]-N,N-dipropylacetamide
CID 60542861
2-[3-(1-aminoethyl)pyrrolidin-1-yl]-N,N-bis(prop-2-enyl)acetamide
CID 112630380
2-(4-amino-3-methylpiperidin-1-yl)-N,N-dipropylacetamide;hydrochloride
CID 119925188
2-[4-(1-aminoethyl)piperidin-1-yl]-N-propan-2-ylacetamide
CID 63596067
2-[4-(1-aminoethyl)piperidin-1-yl]-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide
CID 63595362
1-(4-acetylpiperazin-1-yl)-2-[4-(1-aminoethyl)piperidin-1-yl]ethanone
CID 63594840
2-[4-(1-aminoethyl)piperidin-1-yl]-1-piperidin-1-ylethanone
CID 63595543
2-[4-(1-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide;hydrochloride
CID 119920920
1-[2-(dipropylamino)-2-oxoethyl]-4-methylpiperidine-4-carboxylic acid
CID 63125080
2-[3-(1-aminoethyl)pyrrolidin-1-yl]-1-(4-methylpiperazin-1-yl)ethanone
CID 103976457
2-[3-(1-aminoethyl)pyrrolidin-1-yl]-N-methyl-N-[2-oxo-2-(propylamino)ethyl]acetamide
CID 115969289
1-(1-hexylpiperidin-4-yl)ethanamine
CID 63595820

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-aminoethyl)piperidin-1-yl]-N,N-dipropylacetamide?
The IUPAC name of 2-[4-(1-aminoethyl)piperidin-1-yl]-N,N-dipropylacetamide (CID 55217068) is 2-[4-(1-aminoethyl)piperidin-1-yl]-N,N-dipropylacetamide.
What is the SMILES notation for 2-[4-(1-aminoethyl)piperidin-1-yl]-N,N-dipropylacetamide?
The canonical SMILES for 2-[4-(1-aminoethyl)piperidin-1-yl]-N,N-dipropylacetamide is CCCN(CCC)C(=O)CN1CCC(C(C)N)CC1.
What is the InChIKey of 2-[4-(1-aminoethyl)piperidin-1-yl]-N,N-dipropylacetamide?
The InChIKey is MNQTWKRSJBVSRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-4-8-18(9-5-2)15(19)12-17-10-6-14(7-11-17)13(3)16/h13-14H,4-12,16H2,1-3H3.
What are the key properties of 2-[4-(1-aminoethyl)piperidin-1-yl]-N,N-dipropylacetamide?
2-[4-(1-aminoethyl)piperidin-1-yl]-N,N-dipropylacetamide has a molecular weight of 269.43 g/mol, XLogP of 1.69, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-aminoethyl)piperidin-1-yl]-N,N-dipropylacetamide is sourced from PubChem (CID 55217068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).