methyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate

C14H26N2O3 — CID 63128303

IUPACmethyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate
SMILESCCC1(C(=O)N(CC(=O)OC)C(C)C)CCNCC1
InChIInChI=1S/C14H26N2O3/c1-5-14(6-8-15-9-7-14)13(18)16(11(2)3)10-12(17)19-4/h11,15H,5-10H2,1-4H3
InChIKeyIPFQNGSNHGYXOM-UHFFFAOYSA-N
MW270.37 g/mol
LogP1.18
Rot. Bonds5

About methyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate

methyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate (PubChem CID 63128303) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is methyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate.

Molecular Properties

Compound Namemethyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate
PubChem CID63128303
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Namemethyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate
SMILESCCC1(C(=O)N(CC(=O)OC)C(C)C)CCNCC1
InChIInChI=1S/C14H26N2O3/c1-5-14(6-8-15-9-7-14)13(18)16(11(2)3)10-12(17)19-4/h11,15H,5-10H2,1-4H3
InChIKeyIPFQNGSNHGYXOM-UHFFFAOYSA-N
XLogP1.18
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[(3-ethylpyrrolidine-3-carbonyl)-propan-2-ylamino]acetate
CID 55164952
ethyl 2-[(3-ethylpiperidine-3-carbonyl)-propan-2-ylamino]acetate
CID 63131353
4-ethyl-N-pentyl-N-propan-2-ylpiperidine-4-carboxamide
CID 63128354
N-(2-cyanoethyl)-4-ethyl-N-propan-2-ylpiperidine-4-carboxamide
CID 63128126
3-ethyl-N-(2-methylpropyl)-N-propan-2-ylpyrrolidine-3-carboxamide
CID 63144055
methyl 2-[piperidine-4-carbonyl(propan-2-yl)amino]acetate
CID 54871718
N-(2-amino-2-oxoethyl)-N-propan-2-yl-3-propylpyrrolidine-3-carboxamide
CID 63138504
4-ethyl-N-(1-hydroxypropan-2-yl)-N-methylpiperidine-4-carboxamide
CID 104551835
2-[butan-2-yl-(3-ethylpyrrolidine-3-carbonyl)amino]acetic acid
CID 55164380
methyl 2-[methyl-(3-propylpyrrolidine-3-carbonyl)amino]acetate
CID 63143463
4-ethyl-N-methoxypiperidine-4-carboxamide
CID 64974919
N-(3-hydroxypropyl)-N-propan-2-yl-4-propylpiperidine-4-carboxamide
CID 63128773

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate?
The IUPAC name of methyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate (CID 63128303) is methyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate.
What is the SMILES notation for methyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate?
The canonical SMILES for methyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate is CCC1(C(=O)N(CC(=O)OC)C(C)C)CCNCC1.
What is the InChIKey of methyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate?
The InChIKey is IPFQNGSNHGYXOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-5-14(6-8-15-9-7-14)13(18)16(11(2)3)10-12(17)19-4/h11,15H,5-10H2,1-4H3.
What are the key properties of methyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate?
methyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate has a molecular weight of 270.37 g/mol, XLogP of 1.18, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(4-ethylpiperidine-4-carbonyl)-propan-2-ylamino]acetate is sourced from PubChem (CID 63128303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).