3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride

C15H31ClN2O2 — CID 120502230

IUPAC3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride
SMILESCCOC(CCNC(=O)C(C)C(C)N)C1CCCC1.Cl
InChIInChI=1S/C15H30N2O2.ClH/c1-4-19-14(13-7-5-6-8-13)9-10-17-15(18)11(2)12(3)16;/h11-14H,4-10,16H2,1-3H3,(H,17,18);1H
InChIKeyHMSIREODXLHUTI-UHFFFAOYSA-N
MW306.88 g/mol
LogP2.49
Rot. Bonds8

About 3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride

3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride (PubChem CID 120502230) has the molecular formula C15H31ClN2O2 and a molecular weight of 306.88 g/mol. Its IUPAC name is 3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride
PubChem CID120502230
Molecular FormulaC15H31ClN2O2
Molecular Weight306.88 g/mol
Exact Mass306.21
IUPAC Name3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride
SMILESCCOC(CCNC(=O)C(C)C(C)N)C1CCCC1.Cl
InChIInChI=1S/C15H30N2O2.ClH/c1-4-19-14(13-7-5-6-8-13)9-10-17-15(18)11(2)12(3)16;/h11-14H,4-10,16H2,1-3H3,(H,17,18);1H
InChIKeyHMSIREODXLHUTI-UHFFFAOYSA-N
XLogP2.49
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.88
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride?
The IUPAC name of 3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride (CID 120502230) is 3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride.
What is the SMILES notation for 3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride?
The canonical SMILES for 3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride is CCOC(CCNC(=O)C(C)C(C)N)C1CCCC1.Cl.
What is the InChIKey of 3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride?
The InChIKey is HMSIREODXLHUTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2.ClH/c1-4-19-14(13-7-5-6-8-13)9-10-17-15(18)11(2)12(3)16;/h11-14H,4-10,16H2,1-3H3,(H,17,18);1H.
What are the key properties of 3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride?
3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride has a molecular weight of 306.88 g/mol, XLogP of 2.49, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(3-cyclopentyl-3-ethoxypropyl)-2-methylbutanamide;hydrochloride is sourced from PubChem (CID 120502230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).