N-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide

C16H32N4O2 — CID 95335405

IUPACN-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide
SMILESCCN1CCC(NC(=O)CN2CCN(C[C@H](C)O)CC2)CC1
InChIInChI=1S/C16H32N4O2/c1-3-18-6-4-15(5-7-18)17-16(22)13-20-10-8-19(9-11-20)12-14(2)21/h14-15,21H,3-13H2,1-2H3,(H,17,22)/t14-/m0/s1
InChIKeyKYSARBGIQJXJIY-AWEZNQCLSA-N
MW312.46 g/mol
LogP-0.41
Rot. Bonds6

About N-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide

N-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide (PubChem CID 95335405) has the molecular formula C16H32N4O2 and a molecular weight of 312.46 g/mol. Its IUPAC name is N-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide
PubChem CID95335405
Molecular FormulaC16H32N4O2
Molecular Weight312.46 g/mol
Exact Mass312.25
IUPAC NameN-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide
SMILESCCN1CCC(NC(=O)CN2CCN(C[C@H](C)O)CC2)CC1
InChIInChI=1S/C16H32N4O2/c1-3-18-6-4-15(5-7-18)17-16(22)13-20-10-8-19(9-11-20)12-14(2)21/h14-15,21H,3-13H2,1-2H3,(H,17,22)/t14-/m0/s1
InChIKeyKYSARBGIQJXJIY-AWEZNQCLSA-N
XLogP-0.41
TPSA59.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.46
LogP ≤ 5-0.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-ethylpiperidin-4-yl)-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide
CID 110019949
N-[1-(2-methylpropyl)piperidin-4-yl]propanamide
CID 71193586
N-cyclopropyl-2-[4-[(2S)-2-cyclopropyl-2-hydroxyethyl]piperazin-1-yl]acetamide
CID 97038977
3-[4-[2-(cyclopentylamino)-2-oxoethyl]piperazin-1-yl]-2-methylpropanoic acid
CID 82323003
N-(1-ethylpiperidin-4-yl)-2-(methylamino)propanamide
CID 62637523
N-cyclopropyl-2-[1-(1-ethylpiperidin-4-yl)ethylamino]acetamide
CID 43568260
N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-ethoxypropanamide
CID 51093329
2-[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-yl]-N-(1-ethylpiperidin-4-yl)acetamide
CID 30963137
2-(cyclopropylmethylamino)-N-(1-ethylpiperidin-4-yl)acetamide
CID 54917428
2-(4-methylpiperidin-1-yl)-N-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 157336758
N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-methylsulfanylpropanamide
CID 47057659
5-[(1-ethylpiperidin-4-yl)amino]-3-methyl-5-oxopentanoic acid
CID 62963713

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide?
The IUPAC name of N-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide (CID 95335405) is N-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide.
What is the SMILES notation for N-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide?
The canonical SMILES for N-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide is CCN1CCC(NC(=O)CN2CCN(C[C@H](C)O)CC2)CC1.
What is the InChIKey of N-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide?
The InChIKey is KYSARBGIQJXJIY-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H32N4O2/c1-3-18-6-4-15(5-7-18)17-16(22)13-20-10-8-19(9-11-20)12-14(2)21/h14-15,21H,3-13H2,1-2H3,(H,17,22)/t14-/m0/s1.
What are the key properties of N-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide?
N-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide has a molecular weight of 312.46 g/mol, XLogP of -0.41, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide is sourced from PubChem (CID 95335405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).