N-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride

C14H27ClN2O2 — CID 119672529

IUPACN-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
SMILESCl.O=C(CNCC1CCCO1)NCC1CCCCC1
InChIInChI=1S/C14H26N2O2.ClH/c17-14(11-15-10-13-7-4-8-18-13)16-9-12-5-2-1-3-6-12;/h12-13,15H,1-11H2,(H,16,17);1H
InChIKeySDJSJWRVKNEHSC-UHFFFAOYSA-N
MW290.83 g/mol
LogP1.87
Rot. Bonds6

About N-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride

N-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride (PubChem CID 119672529) has the molecular formula C14H27ClN2O2 and a molecular weight of 290.83 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
PubChem CID119672529
Molecular FormulaC14H27ClN2O2
Molecular Weight290.83 g/mol
Exact Mass290.18
IUPAC NameN-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
SMILESCl.O=C(CNCC1CCCO1)NCC1CCCCC1
InChIInChI=1S/C14H26N2O2.ClH/c17-14(11-15-10-13-7-4-8-18-13)16-9-12-5-2-1-3-6-12;/h12-13,15H,1-11H2,(H,16,17);1H
InChIKeySDJSJWRVKNEHSC-UHFFFAOYSA-N
XLogP1.87
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.83
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[(2R)-oxolan-2-yl]methyl]-2-[[(2R)-oxolan-2-yl]methylamino]acetamide
CID 7437120
oxalic acid;N-(oxolan-2-ylmethyl)-2-(oxolan-2-ylmethylamino)acetamide
CID 175652932
2-cyclohexyl-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 1072431
2-cyclopentyl-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 94814349
N-cyclooctyl-2-(oxolan-2-ylmethylamino)acetamide
CID 119674119
methyl 3-[[2-(oxolan-2-ylmethylamino)acetyl]amino]propanoate;hydrochloride
CID 119726630
2-(2-methoxyethylamino)-N-(oxolan-2-ylmethyl)acetamide;hydrochloride
CID 119670121
N-(3-methylbutyl)-2-(oxolan-2-ylmethylamino)acetamide
CID 60671403
2-(oxolan-2-yl)-N-(oxolan-2-ylmethyl)acetamide
CID 110696563
methyl 2-[[(2R)-oxolan-2-yl]methylamino]acetate
CID 28585559
2-(2-methoxyethylamino)-N-(oxan-2-ylmethyl)acetamide
CID 79281834
1-cyclopropyl-N-(oxolan-2-ylmethyl)methanamine
CID 3607647

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride?
The IUPAC name of N-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride (CID 119672529) is N-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride.
What is the SMILES notation for N-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride?
The canonical SMILES for N-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride is Cl.O=C(CNCC1CCCO1)NCC1CCCCC1.
What is the InChIKey of N-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride?
The InChIKey is SDJSJWRVKNEHSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2.ClH/c17-14(11-15-10-13-7-4-8-18-13)16-9-12-5-2-1-3-6-12;/h12-13,15H,1-11H2,(H,16,17);1H.
What are the key properties of N-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride?
N-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride has a molecular weight of 290.83 g/mol, XLogP of 1.87, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride is sourced from PubChem (CID 119672529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).