N-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide

C18H35N3O — CID 119928234

IUPACN-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide
SMILESCCNCC1CCN(CC(=O)N(CC)C2CCCCC2)CC1
InChIInChI=1S/C18H35N3O/c1-3-19-14-16-10-12-20(13-11-16)15-18(22)21(4-2)17-8-6-5-7-9-17/h16-17,19H,3-15H2,1-2H3
InChIKeyQCFHPEGPXHKGLH-UHFFFAOYSA-N
MW309.50 g/mol
LogP2.49
Rot. Bonds7

About N-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide

N-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide (PubChem CID 119928234) has the molecular formula C18H35N3O and a molecular weight of 309.50 g/mol. Its IUPAC name is N-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide
PubChem CID119928234
Molecular FormulaC18H35N3O
Molecular Weight309.50 g/mol
Exact Mass309.28
IUPAC NameN-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide
SMILESCCNCC1CCN(CC(=O)N(CC)C2CCCCC2)CC1
InChIInChI=1S/C18H35N3O/c1-3-19-14-16-10-12-20(13-11-16)15-18(22)21(4-2)17-8-6-5-7-9-17/h16-17,19H,3-15H2,1-2H3
InChIKeyQCFHPEGPXHKGLH-UHFFFAOYSA-N
XLogP2.49
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.50
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-aminopyrrolidin-1-yl)-N-cyclohexyl-N-ethylacetamide;hydrochloride
CID 119917689
N-cyclohexyl-N-ethyl-2-[4-(2-hydroxyethyl)piperazin-1-yl]acetamide
CID 60689929
N-cyclopentyl-N-ethyl-2-piperazin-1-ylacetamide
CID 43541539
N-cyclohexyl-N-ethyl-2-[3-(methylaminomethyl)piperidin-1-yl]acetamide;hydrochloride
CID 119914794
N-cyclohexyl-N-ethyl-2-(ethylamino)acetamide
CID 60686638
N-cyclohexyl-2-(1,4-diazepan-1-yl)-N-ethylacetamide;hydrochloride
CID 119906882
tert-butyl 4-[2-[cyclohexyl(ethyl)amino]-2-oxoethyl]piperazine-1-carboxylate
CID 55591816
N,N-diethyl-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide
CID 63249005
2-[4-(ethylaminomethyl)piperidin-1-yl]-1-pyrrolidin-1-ylethanone
CID 63849774
N-(cyclopropylmethyl)-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide
CID 63848050
N-cyclohexyl-N-ethyl-2-[2-(hydroxymethyl)-3-methylpyrrolidin-1-yl]acetamide
CID 102788933
2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide
CID 79992651

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide?
The IUPAC name of N-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide (CID 119928234) is N-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide is CCNCC1CCN(CC(=O)N(CC)C2CCCCC2)CC1.
What is the InChIKey of N-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide?
The InChIKey is QCFHPEGPXHKGLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N3O/c1-3-19-14-16-10-12-20(13-11-16)15-18(22)21(4-2)17-8-6-5-7-9-17/h16-17,19H,3-15H2,1-2H3.
What are the key properties of N-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide?
N-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide has a molecular weight of 309.50 g/mol, XLogP of 2.49, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-ethyl-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 119928234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).