N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide

C15H27N3O3 — CID 51093329

IUPACN-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide
SMILESCCOC(C)C(=O)NC1CCN(CC(=O)NC2CC2)CC1
InChIInChI=1S/C15H27N3O3/c1-3-21-11(2)15(20)17-13-6-8-18(9-7-13)10-14(19)16-12-4-5-12/h11-13H,3-10H2,1-2H3,(H,16,19)(H,17,20)
InChIKeyKXQGCXCOFAZOJA-UHFFFAOYSA-N
MW297.40 g/mol
LogP0.27
Rot. Bonds7

About N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide

N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide (PubChem CID 51093329) has the molecular formula C15H27N3O3 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide.

Molecular Properties

Compound NameN-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide
PubChem CID51093329
Molecular FormulaC15H27N3O3
Molecular Weight297.40 g/mol
Exact Mass297.21
IUPAC NameN-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide
SMILESCCOC(C)C(=O)NC1CCN(CC(=O)NC2CC2)CC1
InChIInChI=1S/C15H27N3O3/c1-3-21-11(2)15(20)17-13-6-8-18(9-7-13)10-14(19)16-12-4-5-12/h11-13H,3-10H2,1-2H3,(H,16,19)(H,17,20)
InChIKeyKXQGCXCOFAZOJA-UHFFFAOYSA-N
XLogP0.27
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-methylsulfanylpropanamide
CID 47057659
N-(4-aminocyclohexyl)-2-ethoxypropanamide
CID 119478328
N-cyclohexyl-2-ethoxypropanamide
CID 137320539
2-[4-[2-(butan-2-ylamino)-2-oxoethyl]piperazin-1-yl]-N-(4-methylcyclohexyl)acetamide
CID 134045389
N-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide
CID 95335405
2-(4-aminopiperidin-1-yl)-N-(1-propylpiperidin-4-yl)acetamide
CID 79328634
2-(4-methylpiperidin-1-yl)-N-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 157336758
N-cyclopentyl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide
CID 63847192
N-(1-acetylpiperidin-4-yl)-2-(4-methoxypiperidin-1-yl)acetamide
CID 78847459
2-[4-(methylaminomethyl)piperidin-1-yl]-N-(4-methylcyclohexyl)acetamide
CID 63248834
N-(1-ethylpiperidin-4-yl)-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide
CID 110019949
methyl 1-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxoethyl]piperidine-4-carboxylate
CID 8754691

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide?
The IUPAC name of N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide (CID 51093329) is N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide.
What is the SMILES notation for N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide?
The canonical SMILES for N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide is CCOC(C)C(=O)NC1CCN(CC(=O)NC2CC2)CC1.
What is the InChIKey of N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide?
The InChIKey is KXQGCXCOFAZOJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O3/c1-3-21-11(2)15(20)17-13-6-8-18(9-7-13)10-14(19)16-12-4-5-12/h11-13H,3-10H2,1-2H3,(H,16,19)(H,17,20).
What are the key properties of N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide?
N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide has a molecular weight of 297.40 g/mol, XLogP of 0.27, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide is sourced from PubChem (CID 51093329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).